2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 2-[[4-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]-1-piperidyl]sulfonyl]benzoic acid CAS Name: 2-[[4-[[[4-(4-methoxyphenyl)-2-thiazolyl]amino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 2-[4-[[4-(4-methoxyphenyl)-1,3-thiazol-2-yl]carbamoyl]piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 2-[4-[[4-(4-methoxyphenyl)thiazol-2-yl]carbamoyl]piperidino]sulfonylbenzoic acid Formula: C23H23N3O6S2 MolecularWeight: 501.57522

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CSC(=N2)NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=CC=C4C(=O)O

InChI

InChI=1S/C23H23N3O6S2/c1-32-17-8-6-15(7-9-17)19-14-33-23(24-19)25-21(27)16-10-12-26(13-11-16)34(30,31)20-5-3-2-4-18(20)22(28)29/h2-9,14,16H,10-13H2,1H3,(H,28,29)(H,24,25,27)