3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)-oxidanyl-methyl]quinolin-2-yl]methylamino]propanenitrile

Systemtic Name: 3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-(3-methylimidazol-4-yl)-oxidanyl-methyl]quinolin-2-yl]methylamino]propanenitrile Openeye Name: 3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-quinolyl]methylamino]propanenitrile CAS Name: 3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methyl-4-imidazolyl)methyl]-2-quinolinyl]methylamino]propanenitrile IUPAC Name: 3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]quinolin-2-yl]methylamino]propanenitrile Traditional Name: 3-[[4-(3-chlorophenyl)-6-[(4-chlorophenyl)-hydroxy-(3-methylimidazol-4-yl)methyl]-2-quinolyl]methylamino]propionitrile Formula: C30H25Cl2N5O MolecularWeight: 542.4584

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N=C(C=C4C5=CC(=CC=C5)Cl)CNCCC#N)O

Isomeric SMILES

CN1C=NC=C1C(C2=CC=C(C=C2)Cl)(C3=CC4=C(C=C3)N=C(C=C4C5=CC(=CC=C5)Cl)CNCCC#N)O

InChI

InChI=1S/C30H25Cl2N5O/c1-37-19-35-18-29(37)30(38,21-6-9-23(31)10-7-21)22-8-11-28-27(15-22)26(20-4-2-5-24(32)14-20)16-25(36-28)17-34-13-3-12-33/h2,4-11,14-16,18-19,34,38H,3,13,17H2,1H3