2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide

Systemtic Name: 2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Openeye Name: 2-(p-tolylsulfonylamino)-N-[4-(4-pyridylmethyl)phenyl]propanamide CAS Name: 2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide IUPAC Name: 2-[(4-methylphenyl)sulfonylamino]-N-[4-(pyridin-4-ylmethyl)phenyl]propanamide Traditional Name: N-[4-(4-pyridylmethyl)phenyl]-2-(tosylamino)propionamide Formula: C22H23N3O3S MolecularWeight: 409.50132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC(C)C(=O)NC2=CC=C(C=C2)CC3=CC=NC=C3

InChI

InChI=1S/C22H23N3O3S/c1-16-3-9-21(10-4-16)29(27,28)25-17(2)22(26)24-20-7-5-18(6-8-20)15-19-11-13-23-14-12-19/h3-14,17,25H,15H2,1-2H3,(H,24,26)