N-(4-ethylphenyl)-2-methoxy-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-(4-ethylphenyl)-2-methoxy-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-(4-ethylphenyl)-2-methoxy-5-[4-(3-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-(4-ethylphenyl)-2-methoxy-5-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-(4-ethylphenyl)-2-methoxy-5-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-(4-ethylphenyl)-2-methoxy-5-[4-(3-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C25H29N3O4S2 MolecularWeight: 499.64546

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CSC=C4)OC

Isomeric SMILES

CCC1=CC=C(C=C1)NS(=O)(=O)C2=C(C=CC(=C2)C(=O)N3CCN(CC3)CC4=CSC=C4)OC

InChI

InChI=1S/C25H29N3O4S2/c1-3-19-4-7-22(8-5-19)26-34(30,31)24-16-21(6-9-23(24)32-2)25(29)28-13-11-27(12-14-28)17-20-10-15-33-18-20/h4-10,15-16,18,26H,3,11-14,17H2,1-2H3