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

Systemtic Name: 2-methyl-N-(phenylmethyl)-5-[4-(thiophen-3-ylmethyl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-benzyl-2-methyl-5-[4-(3-thienylmethyl)piperazine-1-carbonyl]benzenesulfonamide CAS Name: 2-methyl-5-[oxo-[4-(3-thiophenylmethyl)-1-piperazinyl]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-2-methyl-5-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-benzyl-2-methyl-5-[4-(3-thenyl)piperazine-1-carbonyl]benzenesulfonamide Formula: C24H27N3O3S2 MolecularWeight: 469.61948

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)NCC4=CC=CC=C4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCN(CC2)CC3=CSC=C3)S(=O)(=O)NCC4=CC=CC=C4

InChI

InChI=1S/C24H27N3O3S2/c1-19-7-8-22(15-23(19)32(29,30)25-16-20-5-3-2-4-6-20)24(28)27-12-10-26(11-13-27)17-21-9-14-31-18-21/h2-9,14-15,18,25H,10-13,16-17H2,1H3