3-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-[1-[(4-chlorophenyl)methyl]-3-indolyl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-[1-[(4-chlorophenyl)methyl]indol-3-yl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-[1-(4-chlorobenzyl)indol-3-yl]-2-(5,6-dimethyl-1H-benzimidazol-2-yl)acrylonitrile Formula: C27H21ClN4 MolecularWeight: 436.93544

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)Cl)C#N

Isomeric SMILES

CC1=CC2=C(C=C1C)N=C(N2)C(=CC3=CN(C4=CC=CC=C43)CC5=CC=C(C=C5)Cl)C#N

InChI

InChI=1S/C27H21ClN4/c1-17-11-24-25(12-18(17)2)31-27(30-24)20(14-29)13-21-16-32(26-6-4-3-5-23(21)26)15-19-7-9-22(28)10-8-19/h3-13,16H,15H2,1-2H3,(H,30,31)