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

Systemtic Name: 4-bromanyl-N-cyclopropyl-3-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: 4-bromo-N-cyclopropyl-3-[4-(3-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 4-bromo-N-cyclopropyl-3-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]benzenesulfonamide IUPAC Name: 4-bromo-N-cyclopropyl-3-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: 4-bromo-N-cyclopropyl-3-[4-(3-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C19H22BrN3O3S2 MolecularWeight: 484.43028

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=CSC=C4

Isomeric SMILES

C1CC1NS(=O)(=O)C2=CC(=C(C=C2)Br)C(=O)N3CCN(CC3)CC4=CSC=C4

InChI

InChI=1S/C19H22BrN3O3S2/c20-18-4-3-16(28(25,26)21-15-1-2-15)11-17(18)19(24)23-8-6-22(7-9-23)12-14-5-10-27-13-14/h3-5,10-11,13,15,21H,1-2,6-9,12H2