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

Systemtic Name: N-[(4-chlorophenyl)methyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Openeye Name: N-[(4-chlorophenyl)methyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide CAS Name: N-[(4-chlorophenyl)methyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)thio]propanamide IUPAC Name: N-[(4-chlorophenyl)methyl]-2-[(4-cyclohexyl-5-methyl-1,2,4-triazol-3-yl)sulfanyl]propanamide Traditional Name: N-(4-chlorobenzyl)-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=NN=C(N1C2CCCCC2)SC(C)C(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

CC1=NN=C(N1C2CCCCC2)SC(C)C(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C19H25ClN4OS/c1-13(18(25)21-12-15-8-10-16(20)11-9-15)26-19-23-22-14(2)24(19)17-6-4-3-5-7-17/h8-11,13,17H,3-7,12H2,1-2H3,(H,21,25)