N-(3-cyanophenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-(3-cyanophenyl)-3-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-(3-cyanophenyl)-3-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-(3-cyanophenyl)-3-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-(3-cyanophenyl)-3-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(3-cyanophenyl)-3-(3-ketopiperazino)sulfonyl-benzamide Formula: C18H16N4O4S MolecularWeight: 384.40904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#N

Isomeric SMILES

C1CN(CC(=O)N1)S(=O)(=O)C2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C#N

InChI

InChI=1S/C18H16N4O4S/c19-11-13-3-1-5-15(9-13)21-18(24)14-4-2-6-16(10-14)27(25,26)22-8-7-20-17(23)12-22/h1-6,9-10H,7-8,12H2,(H,20,23)(H,21,24)