N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-(1-cyclopropyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-4,5-dimethyl-1-phenyl-2-pyrrolyl)-2-[(1-cyclopropyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-dimethyl-1-phenylpyrrol-2-yl)-2-(1-cyclopropyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(3-cyano-4,5-dimethyl-1-phenyl-pyrrol-2-yl)-2-[(1-cyclopropyltetrazol-5-yl)thio]acetamide Formula: C19H19N7OS MolecularWeight: 393.46546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NN=NN2C3CC3)C4=CC=CC=C4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NN=NN2C3CC3)C4=CC=CC=C4)C

InChI

InChI=1S/C19H19N7OS/c1-12-13(2)25(14-6-4-3-5-7-14)18(16(12)10-20)21-17(27)11-28-19-22-23-24-26(19)15-8-9-15/h3-7,15H,8-9,11H2,1-2H3,(H,21,27)