N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide

Systemtic Name: N-(3-cyano-4,5-dimethyl-thiophen-2-yl)-2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanamide Openeye Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetamide CAS Name: N-(3-cyano-4,5-dimethyl-2-thiophenyl)-2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]acetamide IUPAC Name: N-(3-cyano-4,5-dimethylthiophen-2-yl)-2-[(4-cyclohexyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetamide Traditional Name: N-(3-cyano-4,5-dimethyl-2-thienyl)-2-[[4-cyclohexyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetamide Formula: C21H23N5OS3 MolecularWeight: 457.63522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C#N)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CS4)C

Isomeric SMILES

CC1=C(SC(=C1C#N)NC(=O)CSC2=NN=C(N2C3CCCCC3)C4=CC=CS4)C

InChI

InChI=1S/C21H23N5OS3/c1-13-14(2)30-20(16(13)11-22)23-18(27)12-29-21-25-24-19(17-9-6-10-28-17)26(21)15-7-4-3-5-8-15/h6,9-10,15H,3-5,7-8,12H2,1-2H3,(H,23,27)