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

Systemtic Name: N-cyclopropyl-2-methoxy-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-cyclopropyl-2-methoxy-5-[4-(3-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: N-cyclopropyl-2-methoxy-5-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: N-cyclopropyl-2-methoxy-5-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-cyclopropyl-2-methoxy-5-[4-(3-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C20H25N3O4S2 MolecularWeight: 435.5602

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)NC4CC4

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)NC4CC4

InChI

InChI=1S/C20H25N3O4S2/c1-27-18-5-2-16(12-19(18)29(25,26)21-17-3-4-17)20(24)23-9-7-22(8-10-23)13-15-6-11-28-14-15/h2,5-6,11-12,14,17,21H,3-4,7-10,13H2,1H3