4-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pentanamide

Systemtic Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pentanamide Openeye Name: 4-methyl-2-(p-tolylsulfonylamino)-N-[4-(3-pyridylmethylsulfanyl)phenyl]pentanamide CAS Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[4-(3-pyridinylmethylthio)phenyl]pentanamide IUPAC Name: 4-methyl-2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-3-ylmethylsulfanyl)phenyl]pentanamide Traditional Name: 4-methyl-N-[4-(3-pyridylmethylthio)phenyl]-2-(tosylamino)valeramide Formula: C25H29N3O3S2 MolecularWeight: 483.64606

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(CC(C)C)C(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3

InChI

InChI=1S/C25H29N3O3S2/c1-18(2)15-24(28-33(30,31)23-12-6-19(3)7-13-23)25(29)27-21-8-10-22(11-9-21)32-17-20-5-4-14-26-16-20/h4-14,16,18,24,28H,15,17H2,1-3H3,(H,27,29)