Cis-[4,5-Bis-(4-Chlorophenyl)-2-(2-Isopropoxy-4-Methoxyphenyl)-4,5-Dihyd Roimidazol-1-Yl]-Piperazin-1-Yl-Methanone (Q27094984)

ZINC14881088 (English)

1-{[4,5-bis(4-chlorophenyl)-2-(2-isopropoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl]carbonyl}piperazine

4 October 2016

stereoisomer of

1 reference

based on heuristic

inferred from InChI

chemical formula

C₃₀H₃₂Cl₂N₄O₃

1 reference

ZINC14881088 (English)

4 October 2016

canonical SMILES

CC(C)OC1=C(C=CC(=C1)OC)C2=NC(C(N2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

1 reference

ZINC14881088 (English)

4 October 2016

isomeric SMILES

CC(C)OC1=C(C=CC(=C1)OC)C2=N[C@@H]([C@H](N2C(=O)N3CCNCC3)C4=CC=C(C=C4)Cl)C5=CC=C(C=C5)Cl

1 reference

ZINC14881088 (English)

InChI=1S/C30H32Cl2N4O3/c1-19(2)39-26-18-24(38-3)12-13-25(26)29-34-27(20-4-8-22(31)9-5-20)28(21-6-10-23(32)11-7-21)36(29)30(37)35-16-14-33-15-17-35/h4-13,18-19,27-28,33H,14-17H2,1-3H3/t27-,28-/m1/s1

4 October 2016

Identifiers

InChI

1 reference

ZINC14881088 (English)

ZXIPEZDMQNYFOO-VSGBNLITSA-N

4 October 2016

InChIKey

1 reference

ZINC14881088 (English)

4 October 2016

1 reference

[(4R,5R)-4,5-Bis(4-chlorophenyl)-2-(2-isopropoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl](1-piperazinyl)methanone (English)

4 October 2016

2 references

ZINC14881088 (English)