N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide

Systemtic Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonylphenyl]-4-methyl-benzenesulfonamide Openeye Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide CAS Name: N-[2-[[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]phenyl]-4-methylbenzenesulfonamide IUPAC Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-4-methylbenzenesulfonamide Traditional Name: N-[2-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]phenyl]-4-methyl-benzenesulfonamide Formula: C27H28N4O3S2 MolecularWeight: 520.66622

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=NC5=C(S4)C=CC(=C5C)C

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)NC2=CC=CC=C2C(=O)N3CCN(CC3)C4=NC5=C(S4)C=CC(=C5C)C

InChI

InChI=1S/C27H28N4O3S2/c1-18-8-11-21(12-9-18)36(33,34)29-23-7-5-4-6-22(23)26(32)30-14-16-31(17-15-30)27-28-25-20(3)19(2)10-13-24(25)35-27/h4-13,29H,14-17H2,1-3H3