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

Systemtic Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-piperidin-1-ylphenyl)propanamide Openeye Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(1-piperidyl)phenyl]propanamide CAS Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-[4-(1-piperidinyl)phenyl]propanamide IUPAC Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)sulfanyl]-N-(4-piperidin-1-ylphenyl)propanamide Traditional Name: 2-[(5-methyl-4-phenyl-1,2,4-triazol-3-yl)thio]-N-(4-piperidinophenyl)propionamide Formula: C23H27N5OS MolecularWeight: 421.55838

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=C(N1C2=CC=CC=C2)SC(C)C(=O)NC3=CC=C(C=C3)N4CCCCC4

Isomeric SMILES

CC1=NN=C(N1C2=CC=CC=C2)SC(C)C(=O)NC3=CC=C(C=C3)N4CCCCC4

InChI

InChI=1S/C23H27N5OS/c1-17(30-23-26-25-18(2)28(23)21-9-5-3-6-10-21)22(29)24-19-11-13-20(14-12-19)27-15-7-4-8-16-27/h3,5-6,9-14,17H,4,7-8,15-16H2,1-2H3,(H,24,29)