N-(cyclohexylcarbamoyl)-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]thio]propanamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-[[5-methyl-4-(3-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]propanamide Traditional Name: N-(cyclohexylcarbamoyl)-2-[[5-methyl-4-(m-tolyl)-1,2,4-triazol-3-yl]thio]propionamide Formula: C20H27N5O2S MolecularWeight: 401.52568

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=NN=C2SC(C)C(=O)NC(=O)NC3CCCCC3)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=NN=C2SC(C)C(=O)NC(=O)NC3CCCCC3)C

InChI

InChI=1S/C20H27N5O2S/c1-13-8-7-11-17(12-13)25-15(3)23-24-20(25)28-14(2)18(26)22-19(27)21-16-9-5-4-6-10-16/h7-8,11-12,14,16H,4-6,9-10H2,1-3H3,(H2,21,22,26,27)