2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide

Systemtic Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide Openeye Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methyl-butanamide CAS Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)-3-methylbutanamide IUPAC Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-methoxyphenyl)-3-methylbutanamide Traditional Name: 2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-N-(4-methoxyphenyl)-3-methyl-butyramide Formula: C21H30N4O2S MolecularWeight: 402.5535

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SC(C(C)C)C(=O)NC3=CC=C(C=C3)OC

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC(C(C)C)C(=O)NC3=CC=C(C=C3)OC

InChI

InChI=1S/C21H30N4O2S/c1-14(2)19(20(26)22-16-10-12-18(27-4)13-11-16)28-21-24-23-15(3)25(21)17-8-6-5-7-9-17/h10-14,17,19H,5-9H2,1-4H3,(H,22,26)