N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide Openeye Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-piperidine-4-carboxamide CAS Name: N-[4-(1,3-benzothiazol-2-yl)-2-thiazolyl]-1-(4-methoxyphenyl)sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-1,3-thiazol-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide Traditional Name: N-[4-(1,3-benzothiazol-2-yl)thiazol-2-yl]-1-(4-methoxyphenyl)sulfonyl-isonipecotamide Formula: C23H22N4O4S3 MolecularWeight: 514.64018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC(=CS3)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC(=CS3)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C23H22N4O4S3/c1-31-16-6-8-17(9-7-16)34(29,30)27-12-10-15(11-13-27)21(28)26-23-25-19(14-32-23)22-24-18-4-2-3-5-20(18)33-22/h2-9,14-15H,10-13H2,1H3,(H,25,26,28)