[2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] (E)-4-(2-methoxyphenyl)but-2-enoate

Systemtic Name: [2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] (E)-4-(2-methoxyphenyl)but-2-enoate Openeye Name: [2-(thiazol-2-ylcarbamoyl)-3-pyridyl] (E)-4-(2-methoxyphenyl)but-2-enoate CAS Name: (E)-4-(2-methoxyphenyl)-2-butenoic acid [2-[oxo-(2-thiazolylamino)methyl]-3-pyridinyl] ester IUPAC Name: [2-(1,3-thiazol-2-ylcarbamoyl)pyridin-3-yl] (E)-4-(2-methoxyphenyl)but-2-enoate Traditional Name: (E)-4-(2-methoxyphenyl)but-2-enoic acid [2-(thiazol-2-ylcarbamoyl)-3-pyridyl] ester Formula: C20H17N3O4S MolecularWeight: 395.43168

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1CC=CC(=O)OC2=C(N=CC=C2)C(=O)NC3=NC=CS3

Isomeric SMILES

COC1=CC=CC=C1C/C=C/C(=O)OC2=C(N=CC=C2)C(=O)NC3=NC=CS3

InChI

InChI=1S/C20H17N3O4S/c1-26-15-8-3-2-6-14(15)7-4-10-17(24)27-16-9-5-11-21-18(16)19(25)23-20-22-12-13-28-20/h2-6,8-13H,7H2,1H3,(H,22,23,25)/b10-4+