[4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]methanone

Systemtic Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]methanone Openeye Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[2-(cyclopropylmethoxy)-5-methylsulfonyl-phenyl]methanone CAS Name: [4-(1,2-benzothiazol-3-yl)-1-piperazinyl]-[2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]methanone IUPAC Name: [4-(1,2-benzothiazol-3-yl)piperazin-1-yl]-[2-(cyclopropylmethoxy)-5-methylsulfonylphenyl]methanone Traditional Name: [4-(1,2-benzothiazol-3-yl)piperazino]-[2-(cyclopropylmethoxy)-5-mesyl-phenyl]methanone Formula: C23H25N3O4S2 MolecularWeight: 471.5923

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)OCC2CC2)C(=O)N3CCN(CC3)C4=NSC5=CC=CC=C54

InChI

InChI=1S/C23H25N3O4S2/c1-32(28,29)17-8-9-20(30-15-16-6-7-16)19(14-17)23(27)26-12-10-25(11-13-26)22-18-4-2-3-5-21(18)31-24-22/h2-5,8-9,14,16H,6-7,10-13,15H2,1H3