N-[2-[methyl(phenyl)amino]propyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[2-[methyl(phenyl)amino]propyl]-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[2-(N-methylanilino)propyl]-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[2-(N-methylanilino)propyl]-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[2-(N-methylanilino)propyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-[2-(N-methylanilino)propyl]benzamide Formula: C21H26N4O4S MolecularWeight: 430.52054

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Descriptors Computed from Structure

Canonical SMILES:

CC(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2)N(C)C3=CC=CC=C3

Isomeric SMILES

CC(CNC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCNC(=O)C2)N(C)C3=CC=CC=C3

InChI

InChI=1S/C21H26N4O4S/c1-16(24(2)18-6-4-3-5-7-18)14-23-21(27)17-8-10-19(11-9-17)30(28,29)25-13-12-22-20(26)15-25/h3-11,16H,12-15H2,1-2H3,(H,22,26)(H,23,27)