2-[(4-aminocarbonylphenyl)methylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide

Systemtic Name: 2-[(4-aminocarbonylphenyl)methylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide Openeye Name: 2-[(4-carbamoylphenyl)methylsulfanyl]-N,N-dimethyl-pyridine-3-carboxamide CAS Name: 2-[(4-carbamoylphenyl)methylthio]-N,N-dimethyl-3-pyridinecarboxamide IUPAC Name: 2-[(4-carbamoylphenyl)methylsulfanyl]-N,N-dimethylpyridine-3-carboxamide Traditional Name: 2-[(4-carbamoylbenzyl)thio]-N,N-dimethyl-nicotinamide Formula: C16H17N3O2S MolecularWeight: 315.39008

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)C1=C(N=CC=C1)SCC2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CN(C)C(=O)C1=C(N=CC=C1)SCC2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C16H17N3O2S/c1-19(2)16(21)13-4-3-9-18-15(13)22-10-11-5-7-12(8-6-11)14(17)20/h3-9H,10H2,1-2H3,(H2,17,20)