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

Systemtic Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[(1-cyclopentyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethanamide Openeye Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanyl-acetamide CAS Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-2-pyrrolyl)-2-[(1-cyclopentyl-5-tetrazolyl)thio]acetamide IUPAC Name: N-(3-cyano-1-cyclohexyl-4,5-dimethylpyrrol-2-yl)-2-(1-cyclopentyltetrazol-5-yl)sulfanylacetamide Traditional Name: N-(3-cyano-1-cyclohexyl-4,5-dimethyl-pyrrol-2-yl)-2-[(1-cyclopentyltetrazol-5-yl)thio]acetamide Formula: C21H29N7OS MolecularWeight: 427.56626

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NN=NN2C3CCCC3)C4CCCCC4)C

Isomeric SMILES

CC1=C(N(C(=C1C#N)NC(=O)CSC2=NN=NN2C3CCCC3)C4CCCCC4)C

InChI

InChI=1S/C21H29N7OS/c1-14-15(2)27(16-8-4-3-5-9-16)20(18(14)12-22)23-19(29)13-30-21-24-25-26-28(21)17-10-6-7-11-17/h16-17H,3-11,13H2,1-2H3,(H,23,29)