N-[4-(5-aminocarbonyl-1H-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-pyridine-3-carboxamide

Systemtic Name: N-[4-(5-aminocarbonyl-1H-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-phenylsulfanyl-pyridine-3-carboxamide Openeye Name: N-[4-(5-carbamoyl-1H-pyrrol-3-yl)thiazol-2-yl]-2-phenylsulfanyl-pyridine-3-carboxamide CAS Name: N-[4-(5-carbamoyl-1H-pyrrol-3-yl)-2-thiazolyl]-2-(phenylthio)-3-pyridinecarboxamide IUPAC Name: N-[4-(5-carbamoyl-1H-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-phenylsulfanylpyridine-3-carboxamide Traditional Name: N-[4-(5-carbamoyl-1H-pyrrol-3-yl)thiazol-2-yl]-2-(phenylthio)nicotinamide Formula: C20H15N5O2S2 MolecularWeight: 421.4954

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=NC(=CS3)C4=CNC(=C4)C(=O)N

Isomeric SMILES

C1=CC=C(C=C1)SC2=C(C=CC=N2)C(=O)NC3=NC(=CS3)C4=CNC(=C4)C(=O)N

InChI

InChI=1S/C20H15N5O2S2/c21-17(26)15-9-12(10-23-15)16-11-28-20(24-16)25-18(27)14-7-4-8-22-19(14)29-13-5-2-1-3-6-13/h1-11,23H,(H2,21,26)(H,24,25,27)