N-[1-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide

Systemtic Name: N-[1-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]-1-oxidanylidene-3-phenylsulfanyl-propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Openeye Name: N-[2-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]-2-oxo-1-(phenylsulfanylmethyl)ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide CAS Name: N-[1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-1-oxo-3-(phenylthio)propan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide IUPAC Name: N-[1-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-1-oxo-3-phenylsulfanylpropan-2-yl]-2-pyridin-4-yl-3H-benzimidazole-5-carboxamide Traditional Name: N-[2-[[3-(dimethylamino)-2,2-dimethyl-propyl]amino]-2-keto-1-[(phenylthio)methyl]ethyl]-2-(4-pyridyl)-3H-benzimidazole-5-carboxamide Formula: C29H34N6O2S MolecularWeight: 530.68426

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CNC(=O)C(CSC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)CN(C)C

Isomeric SMILES

CC(C)(CNC(=O)C(CSC1=CC=CC=C1)NC(=O)C2=CC3=C(C=C2)N=C(N3)C4=CC=NC=C4)CN(C)C

InChI

InChI=1S/C29H34N6O2S/c1-29(2,19-35(3)4)18-31-28(37)25(17-38-22-8-6-5-7-9-22)34-27(36)21-10-11-23-24(16-21)33-26(32-23)20-12-14-30-15-13-20/h5-16,25H,17-19H2,1-4H3,(H,31,37)(H,32,33)(H,34,36)