5-bromanyl-N-[2-[4-(2,5-dimethylphenyl)piperazin-1-yl]-2-oxidanylidene-ethyl]thiophene-2-sulfonamide

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CNS(=O)(=O)C3=CC=C(S3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)C)N2CCN(CC2)C(=O)CNS(=O)(=O)C3=CC=C(S3)Br

InChI

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