N-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(1-azanyl-1-oxidanylidene-propan-2-yl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-(2-amino-1-methyl-2-oxo-ethyl)phenyl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-(1-amino-1-oxopropan-2-yl)phenyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-(1-amino-1-oxopropan-2-yl)phenyl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-(2-amino-2-keto-1-methyl-ethyl)phenyl]-2-(phenylthio)nicotinamide Formula: C21H19N3O2S MolecularWeight: 377.45946

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)C(=O)N

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2=C(N=CC=C2)SC3=CC=CC=C3)C(=O)N

InChI

InChI=1S/C21H19N3O2S/c1-14(19(22)25)15-9-11-16(12-10-15)24-20(26)18-8-5-13-23-21(18)27-17-6-3-2-4-7-17/h2-14H,1H3,(H2,22,25)(H,24,26)