N-[6-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-1,3-benzothiazol-2-yl]methanesulfonamide

Systemtic Name: N-[6-[4-(3-methoxyphenyl)piperazin-1-yl]carbonyl-1,3-benzothiazol-2-yl]methanesulfonamide Openeye Name: N-[6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1,3-benzothiazol-2-yl]methanesulfonamide CAS Name: N-[6-[[4-(3-methoxyphenyl)-1-piperazinyl]-oxomethyl]-1,3-benzothiazol-2-yl]methanesulfonamide IUPAC Name: N-[6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1,3-benzothiazol-2-yl]methanesulfonamide Traditional Name: N-[6-[4-(3-methoxyphenyl)piperazine-1-carbonyl]-1,3-benzothiazol-2-yl]methanesulfonamide Formula: C20H22N4O4S2 MolecularWeight: 446.54308

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C

Isomeric SMILES

COC1=CC=CC(=C1)N2CCN(CC2)C(=O)C3=CC4=C(C=C3)N=C(S4)NS(=O)(=O)C

InChI

InChI=1S/C20H22N4O4S2/c1-28-16-5-3-4-15(13-16)23-8-10-24(11-9-23)19(25)14-6-7-17-18(12-14)29-20(21-17)22-30(2,26)27/h3-7,12-13H,8-11H2,1-2H3,(H,21,22)