N-methyl-N-(phenylmethyl)-4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-benzenesulfonamide

Systemtic Name: N-methyl-N-(phenylmethyl)-4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-benzenesulfonamide Openeye Name: N-benzyl-4-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide CAS Name: N-methyl-4-[oxo-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)-1-piperazinyl]methyl]-N-(phenylmethyl)benzenesulfonamide IUPAC Name: N-benzyl-N-methyl-4-[4-(4-propan-2-yl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzenesulfonamide Traditional Name: N-benzyl-4-[4-(4-isopropyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide Formula: C29H32N4O3S2 MolecularWeight: 548.71938

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)CC5=CC=CC=C5

Isomeric SMILES

CC(C)C1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(C)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O3S2/c1-21(2)25-10-7-11-26-27(25)30-29(37-26)33-18-16-32(17-19-33)28(34)23-12-14-24(15-13-23)38(35,36)31(3)20-22-8-5-4-6-9-22/h4-15,21H,16-20H2,1-3H3