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

Systemtic Name: N-(3-chloranyl-2-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-(3-chloro-2-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-(3-chloro-2-methylphenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-(3-chloro-2-methylphenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(3-chloro-2-methyl-phenyl)-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propionamide Formula: C19H25ClN4OS MolecularWeight: 392.946

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC(=O)C(C)SC2=NN=C(N2C3CCCCC3)C

InChI

InChI=1S/C19H25ClN4OS/c1-12-16(20)10-7-11-17(12)21-18(25)13(2)26-19-23-22-14(3)24(19)15-8-5-4-6-9-15/h7,10-11,13,15H,4-6,8-9H2,1-3H3,(H,21,25)