4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[(4-propylphenyl)-thiophen-2-yl-methyl]benzamide

Systemtic Name: 4-(3-oxidanylidenepiperazin-1-yl)sulfonyl-N-[(4-propylphenyl)-thiophen-2-yl-methyl]benzamide Openeye Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-[(4-propylphenyl)-(2-thienyl)methyl]benzamide CAS Name: 4-[(3-oxo-1-piperazinyl)sulfonyl]-N-[(4-propylphenyl)-thiophen-2-ylmethyl]benzamide IUPAC Name: 4-(3-oxopiperazin-1-yl)sulfonyl-N-[(4-propylphenyl)-thiophen-2-ylmethyl]benzamide Traditional Name: 4-(3-ketopiperazino)sulfonyl-N-[(4-propylphenyl)-(2-thienyl)methyl]benzamide Formula: C25H27N3O4S2 MolecularWeight: 497.62958

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCNC(=O)C4

Isomeric SMILES

CCCC1=CC=C(C=C1)C(C2=CC=CS2)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCNC(=O)C4

InChI

InChI=1S/C25H27N3O4S2/c1-2-4-18-6-8-19(9-7-18)24(22-5-3-16-33-22)27-25(30)20-10-12-21(13-11-20)34(31,32)28-15-14-26-23(29)17-28/h3,5-13,16,24H,2,4,14-15,17H2,1H3,(H,26,29)(H,27,30)