propan-2-yl 2-[3-[(2-ethoxyphenyl)carbamoyl]-4,6-dimethyl-pyridin-2-yl]sulfanylethanoate

Systemtic Name: propan-2-yl 2-[3-[(2-ethoxyphenyl)carbamoyl]-4,6-dimethyl-pyridin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[[3-[(2-ethoxyphenyl)carbamoyl]-4,6-dimethyl-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-[(2-ethoxyanilino)-oxomethyl]-4,6-dimethyl-2-pyridinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-[(2-ethoxyphenyl)carbamoyl]-4,6-dimethylpyridin-2-yl]sulfanylacetate Traditional Name: 2-[[4,6-dimethyl-3-(o-phenetylcarbamoyl)-2-pyridyl]thio]acetic acid isopropyl ester Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)OC(C)C

Isomeric SMILES

CCOC1=CC=CC=C1NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)OC(C)C

InChI

InChI=1S/C21H26N2O4S/c1-6-26-17-10-8-7-9-16(17)23-20(25)19-14(4)11-15(5)22-21(19)28-12-18(24)27-13(2)3/h7-11,13H,6,12H2,1-5H3,(H,23,25)