N-[2-(dimethylamino)-4-ethyl-phenyl]-2-(diphenylmethyl)sulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[2-(dimethylamino)-4-ethyl-phenyl]-2-(diphenylmethyl)sulfanyl-pyridine-3-carboxamide Openeye Name: 2-benzhydrylsulfanyl-N-[2-(dimethylamino)-4-ethyl-phenyl]pyridine-3-carboxamide CAS Name: N-[2-(dimethylamino)-4-ethylphenyl]-2-[(diphenylmethyl)thio]-3-pyridinecarboxamide IUPAC Name: 2-benzhydrylsulfanyl-N-[2-(dimethylamino)-4-ethylphenyl]pyridine-3-carboxamide Traditional Name: 2-(benzhydrylthio)-N-[2-(dimethylamino)-4-ethyl-phenyl]nicotinamide Formula: C29H29N3OS MolecularWeight: 467.62506

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)NC(=O)C2=C(N=CC=C2)SC(C3=CC=CC=C3)C4=CC=CC=C4)N(C)C

Isomeric SMILES

CCC1=CC(=C(C=C1)NC(=O)C2=C(N=CC=C2)SC(C3=CC=CC=C3)C4=CC=CC=C4)N(C)C

InChI

InChI=1S/C29H29N3OS/c1-4-21-17-18-25(26(20-21)32(2)3)31-28(33)24-16-11-19-30-29(24)34-27(22-12-7-5-8-13-22)23-14-9-6-10-15-23/h5-20,27H,4H2,1-3H3,(H,31,33)