4-[[4-[[4-(4-cyanobutan-2-ylamino)-2-methyl-phenyl]-[4-(diethylamino)phenyl]methyl]-3-methyl-phenyl]amino]pentanenitrile

Systemtic Name: 4-[[4-[[4-(4-cyanobutan-2-ylamino)-2-methyl-phenyl]-[4-(diethylamino)phenyl]methyl]-3-methyl-phenyl]amino]pentanenitrile Openeye Name: 4-[4-[[4-[(3-cyano-1-methyl-propyl)amino]-2-methyl-phenyl]-[4-(diethylamino)phenyl]methyl]-3-methyl-anilino]pentanenitrile CAS Name: 4-[4-[[4-(4-cyanobutan-2-ylamino)-2-methylphenyl]-[4-(diethylamino)phenyl]methyl]-3-methylanilino]pentanenitrile IUPAC Name: 4-[4-[[4-(4-cyanobutan-2-ylamino)-2-methylphenyl]-[4-(diethylamino)phenyl]methyl]-3-methylanilino]pentanenitrile Traditional Name: 4-[4-[[4-[(3-cyano-1-methyl-propyl)amino]-2-methyl-phenyl]-[4-(diethylamino)phenyl]methyl]-3-methyl-anilino]valeronitrile Formula: C35H45N5 MolecularWeight: 535.7653

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)C(C2=C(C=C(C=C2)NC(C)CCC#N)C)C3=C(C=C(C=C3)NC(C)CCC#N)C

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)C(C2=C(C=C(C=C2)NC(C)CCC#N)C)C3=C(C=C(C=C3)NC(C)CCC#N)C

InChI

InChI=1S/C35H45N5/c1-7-40(8-2)32-17-13-29(14-18-32)35(33-19-15-30(23-25(33)3)38-27(5)11-9-21-36)34-20-16-31(24-26(34)4)39-28(6)12-10-22-37/h13-20,23-24,27-28,35,38-39H,7-12H2,1-6H3