N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide

Systemtic Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide Openeye Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxo-1-phenyl-ethyl]-2,1,3-benzothiadiazole-4-sulfonamide CAS Name: N-[2-(4-cyclohexyl-1-piperazinyl)-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide IUPAC Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxo-1-phenylethyl]-2,1,3-benzothiadiazole-4-sulfonamide Traditional Name: N-[2-(4-cyclohexylpiperazino)-2-keto-1-phenyl-ethyl]piazthiole-4-sulfonamide Formula: C24H29N5O3S2 MolecularWeight: 499.64876

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

Isomeric SMILES

C1CCC(CC1)N2CCN(CC2)C(=O)C(C3=CC=CC=C3)NS(=O)(=O)C4=CC=CC5=NSN=C54

InChI

InChI=1S/C24H29N5O3S2/c30-24(29-16-14-28(15-17-29)19-10-5-2-6-11-19)22(18-8-3-1-4-9-18)27-34(31,32)21-13-7-12-20-23(21)26-33-25-20/h1,3-4,7-9,12-13,19,22,27H,2,5-6,10-11,14-17H2