2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]sulfanyl]-N-[3-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]thio]-N-[3-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: 2-[[4-(2-methylphenyl)-1,2,4-triazol-3-yl]sulfanyl]-N-(3-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: 2-[[4-(o-tolyl)-1,2,4-triazol-3-yl]thio]-N-(3-piperidinosulfonylphenyl)propionamide Formula: C23H27N5O3S2 MolecularWeight: 485.62218

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

Isomeric SMILES

CC1=CC=CC=C1N2C=NN=C2SC(C)C(=O)NC3=CC(=CC=C3)S(=O)(=O)N4CCCCC4

InChI

InChI=1S/C23H27N5O3S2/c1-17-9-4-5-12-21(17)28-16-24-26-23(28)32-18(2)22(29)25-19-10-8-11-20(15-19)33(30,31)27-13-6-3-7-14-27/h4-5,8-12,15-16,18H,3,6-7,13-14H2,1-2H3,(H,25,29)