N-(5-azanyl-3-oxidanylidene-4-phenyl-2H-pyrrol-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide

Systemtic Name: N-(5-azanyl-3-oxidanylidene-4-phenyl-2H-pyrrol-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)ethanamide Openeye Name: N-(5-amino-3-oxo-4-phenyl-2H-pyrrol-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide CAS Name: N-(5-amino-3-oxo-4-phenyl-2H-pyrrol-1-yl)-2-(1,3-benzothiazol-2-ylthio)acetamide IUPAC Name: N-(5-amino-3-oxo-4-phenyl-2H-pyrrol-1-yl)-2-(1,3-benzothiazol-2-ylsulfanyl)acetamide Traditional Name: N-(2-amino-4-keto-3-phenyl-2-pyrrolin-1-yl)-2-(1,3-benzothiazol-2-ylthio)acetamide Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=O)C(=C(N1NC(=O)CSC2=NC3=CC=CC=C3S2)N)C4=CC=CC=C4

Isomeric SMILES

C1C(=O)C(=C(N1NC(=O)CSC2=NC3=CC=CC=C3S2)N)C4=CC=CC=C4

InChI

InChI=1S/C19H16N4O2S2/c20-18-17(12-6-2-1-3-7-12)14(24)10-23(18)22-16(25)11-26-19-21-13-8-4-5-9-15(13)27-19/h1-9H,10-11,20H2,(H,22,25)