(2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 3-(2-methylpiperidin-1-yl)sulfonylbenzoate

Systemtic Name: (2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 3-(2-methylpiperidin-1-yl)sulfonylbenzoate Openeye Name: [2-(2-pyridyl)thiazol-4-yl]methyl 3-[(2-methyl-1-piperidyl)sulfonyl]benzoate CAS Name: 3-[(2-methyl-1-piperidinyl)sulfonyl]benzoic acid [2-(2-pyridinyl)-4-thiazolyl]methyl ester IUPAC Name: (2-pyridin-2-yl-1,3-thiazol-4-yl)methyl 3-(2-methylpiperidin-1-yl)sulfonylbenzoate Traditional Name: 3-(2-methylpiperidino)sulfonylbenzoic acid [2-(2-pyridyl)thiazol-4-yl]methyl ester Formula: C22H23N3O4S2 MolecularWeight: 457.56572

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=N4

Isomeric SMILES

CC1CCCCN1S(=O)(=O)C2=CC=CC(=C2)C(=O)OCC3=CSC(=N3)C4=CC=CC=N4

InChI

InChI=1S/C22H23N3O4S2/c1-16-7-3-5-12-25(16)31(27,28)19-9-6-8-17(13-19)22(26)29-14-18-15-30-21(24-18)20-10-2-4-11-23-20/h2,4,6,8-11,13,15-16H,3,5,7,12,14H2,1H3