4-[(4-methylpiperazin-1-yl)methyl]-3-(phenylsulfonyl)thiophene-2-sulfonamide

Systemtic Name: 4-[(4-methylpiperazin-1-yl)methyl]-3-(phenylsulfonyl)thiophene-2-sulfonamide Openeye Name: 3-(benzenesulfonyl)-4-[(4-methylpiperazin-1-yl)methyl]thiophene-2-sulfonamide CAS Name: 3-(benzenesulfonyl)-4-[(4-methyl-1-piperazinyl)methyl]-2-thiophenesulfonamide IUPAC Name: 3-(benzenesulfonyl)-4-[(4-methylpiperazin-1-yl)methyl]thiophene-2-sulfonamide Traditional Name: 3-besyl-4-[(4-methylpiperazino)methyl]thiophene-2-sulfonamide Formula: C16H21N3O4S3 MolecularWeight: 415.55064

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CSC(=C2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)N

Isomeric SMILES

CN1CCN(CC1)CC2=CSC(=C2S(=O)(=O)C3=CC=CC=C3)S(=O)(=O)N

InChI

InChI=1S/C16H21N3O4S3/c1-18-7-9-19(10-8-18)11-13-12-24-16(26(17,22)23)15(13)25(20,21)14-5-3-2-4-6-14/h2-6,12H,7-11H2,1H3,(H2,17,22,23)