N-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-oxidanyl-phenyl)sulfonyl-piperazine-1-carboxamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(5-methyl-2-oxidanyl-phenyl)sulfonyl-piperazine-1-carboxamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(2-hydroxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(2-hydroxy-5-methylphenyl)sulfonyl-1-piperazinecarboxamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(2-hydroxy-5-methylphenyl)sulfonylpiperazine-1-carboxamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(2-hydroxy-5-methyl-phenyl)sulfonyl-piperazine-1-carboxamide Formula: C19H20N4O4S2 MolecularWeight: 432.5165

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)O)S(=O)(=O)N2CCN(CC2)C(=O)NC3=NC4=CC=CC=C4S3

Isomeric SMILES

CC1=CC(=C(C=C1)O)S(=O)(=O)N2CCN(CC2)C(=O)NC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C19H20N4O4S2/c1-13-6-7-15(24)17(12-13)29(26,27)23-10-8-22(9-11-23)19(25)21-18-20-14-4-2-3-5-16(14)28-18/h2-7,12,24H,8-11H2,1H3,(H,20,21,25)