N-(3-methylpyridin-2-yl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-methylpyridin-2-yl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-methyl-2-pyridyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-methyl-2-pyridinyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-methylpyridin-2-yl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 3-(3-ketopiperazino)sulfonyl-N-(3-methyl-2-pyridyl)benzamide Formula: C17H18N4O4S MolecularWeight: 374.41422

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CC1=C(N=CC=C1)NC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C17H18N4O4S/c1-12-4-3-7-19-16(12)20-17(23)13-5-2-6-14(10-13)26(24,25)21-9-8-18-15(22)11-21/h2-7,10H,8-9,11H2,1H3,(H,18,22)(H,19,20,23)