5-bromanyl-N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-sulfonamide

Systemtic Name: 5-bromanyl-N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-sulfonamide Openeye Name: 5-bromo-N-[2-[3-methyl-4-(p-tolyl)piperazin-1-yl]-2-oxo-ethyl]thiophene-2-sulfonamide CAS Name: 5-bromo-N-[2-[3-methyl-4-(4-methylphenyl)-1-piperazinyl]-2-oxoethyl]-2-thiophenesulfonamide IUPAC Name: 5-bromo-N-[2-[3-methyl-4-(4-methylphenyl)piperazin-1-yl]-2-oxoethyl]thiophene-2-sulfonamide Traditional Name: 5-bromo-N-[2-keto-2-[3-methyl-4-(p-tolyl)piperazino]ethyl]thiophene-2-sulfonamide Formula: C18H22BrN3O3S2 MolecularWeight: 472.41958

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)CNS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1CN(CCN1C2=CC=C(C=C2)C)C(=O)CNS(=O)(=O)C3=CC=C(S3)Br

InChI

InChI=1S/C18H22BrN3O3S2/c1-13-3-5-15(6-4-13)22-10-9-21(12-14(22)2)17(23)11-20-27(24,25)18-8-7-16(19)26-18/h3-8,14,20H,9-12H2,1-2H3