3-[(4-methylphenyl)sulfonylamino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide

Systemtic Name: 3-[(4-methylphenyl)sulfonylamino]-N-[6-(3-oxidanylidenepiperazin-1-yl)pyridin-3-yl]propanamide Openeye Name: N-[6-(3-oxopiperazin-1-yl)-3-pyridyl]-3-(p-tolylsulfonylamino)propanamide CAS Name: 3-[(4-methylphenyl)sulfonylamino]-N-[6-(3-oxo-1-piperazinyl)-3-pyridinyl]propanamide IUPAC Name: 3-[(4-methylphenyl)sulfonylamino]-N-[6-(3-oxopiperazin-1-yl)pyridin-3-yl]propanamide Traditional Name: N-[6-(3-ketopiperazino)-3-pyridyl]-3-(tosylamino)propionamide Formula: C19H23N5O4S MolecularWeight: 417.48202

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NCCC(=O)NC2=CN=C(C=C2)N3CCNC(=O)C3

InChI

InChI=1S/C19H23N5O4S/c1-14-2-5-16(6-3-14)29(27,28)22-9-8-18(25)23-15-4-7-17(21-12-15)24-11-10-20-19(26)13-24/h2-7,12,22H,8-11,13H2,1H3,(H,20,26)(H,23,25)