N-butyl-4-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-methyl-benzenesulfonamide

Systemtic Name: N-butyl-4-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazin-1-yl]carbonyl-N-methyl-benzenesulfonamide Openeye Name: N-butyl-4-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide CAS Name: N-butyl-4-[[4-(6-ethoxy-1,3-benzothiazol-2-yl)-1-piperazinyl]-oxomethyl]-N-methylbenzenesulfonamide IUPAC Name: N-butyl-4-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methylbenzenesulfonamide Traditional Name: N-butyl-4-[4-(6-ethoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]-N-methyl-benzenesulfonamide Formula: C25H32N4O4S2 MolecularWeight: 516.67598

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)OCC

Isomeric SMILES

CCCCN(C)S(=O)(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(S3)C=C(C=C4)OCC

InChI

InChI=1S/C25H32N4O4S2/c1-4-6-13-27(3)35(31,32)21-10-7-19(8-11-21)24(30)28-14-16-29(17-15-28)25-26-22-12-9-20(33-5-2)18-23(22)34-25/h7-12,18H,4-6,13-17H2,1-3H3