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

Systemtic Name: N-[4-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]ethanoyl]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]-3-methyl-butanamide CAS Name: N-[4-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]-1-oxoethyl]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]acetyl]phenyl]-3-methylbutanamide Traditional Name: N-[4-[2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]acetyl]phenyl]-3-methyl-butyramide Formula: C22H30N4O2S MolecularWeight: 414.5642

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2CCCCC2)SCC(=O)C3=CC=C(C=C3)NC(=O)CC(C)C

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SCC(=O)C3=CC=C(C=C3)NC(=O)CC(C)C

InChI

InChI=1S/C22H30N4O2S/c1-15(2)13-21(28)23-18-11-9-17(10-12-18)20(27)14-29-22-25-24-16(3)26(22)19-7-5-4-6-8-19/h9-12,15,19H,4-8,13-14H2,1-3H3,(H,23,28)