N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide

Systemtic Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxidanylidene-ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Openeye Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxo-ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide CAS Name: N-[2-(4-cyclohexyl-1-piperazinyl)-2-oxoethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide IUPAC Name: N-[2-(4-cyclohexylpiperazin-1-yl)-2-oxoethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Traditional Name: N-[2-(4-cyclohexylpiperazino)-2-keto-ethyl]-2-methyl-1,3-benzothiazole-6-sulfonamide Formula: C20H28N4O3S2 MolecularWeight: 436.59132

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NCC(=O)N3CCN(CC3)C4CCCCC4

Isomeric SMILES

CC1=NC2=C(S1)C=C(C=C2)S(=O)(=O)NCC(=O)N3CCN(CC3)C4CCCCC4

InChI

InChI=1S/C20H28N4O3S2/c1-15-22-18-8-7-17(13-19(18)28-15)29(26,27)21-14-20(25)24-11-9-23(10-12-24)16-5-3-2-4-6-16/h7-8,13,16,21H,2-6,9-12,14H2,1H3