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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(CC)CC5=CC=CC=C5

Isomeric SMILES

CCC1=C2C(=CC=C1)SC(=N2)N3CCN(CC3)C(=O)C4=CC=C(C=C4)S(=O)(=O)N(CC)CC5=CC=CC=C5

InChI

InChI=1S/C29H32N4O3S2/c1-3-23-11-8-12-26-27(23)30-29(37-26)32-19-17-31(18-20-32)28(34)24-13-15-25(16-14-24)38(35,36)33(4-2)21-22-9-6-5-7-10-22/h5-16H,3-4,17-21H2,1-2H3