N-[(4-ethylphenyl)methyl]-N-methyl-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide

Systemtic Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-benzamide Openeye Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-(3-oxopiperazin-1-yl)sulfonyl-benzamide CAS Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-[(3-oxo-1-piperazinyl)sulfonyl]benzamide IUPAC Name: N-[(4-ethylphenyl)methyl]-N-methyl-4-(3-oxopiperazin-1-yl)sulfonylbenzamide Traditional Name: N-(4-ethylbenzyl)-4-(3-ketopiperazino)sulfonyl-N-methyl-benzamide Formula: C21H25N3O4S MolecularWeight: 415.5059

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

Isomeric SMILES

CCC1=CC=C(C=C1)CN(C)C(=O)C2=CC=C(C=C2)S(=O)(=O)N3CCNC(=O)C3

InChI

InChI=1S/C21H25N3O4S/c1-3-16-4-6-17(7-5-16)14-23(2)21(26)18-8-10-19(11-9-18)29(27,28)24-13-12-22-20(25)15-24/h4-11H,3,12-15H2,1-2H3,(H,22,25)