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

Systemtic Name: propan-2-yl 2-[3-[(4-ethylphenyl)carbamoyl]-4,6-dimethyl-pyridin-2-yl]sulfanylethanoate Openeye Name: isopropyl 2-[[3-[(4-ethylphenyl)carbamoyl]-4,6-dimethyl-2-pyridyl]sulfanyl]acetate CAS Name: 2-[[3-[(4-ethylanilino)-oxomethyl]-4,6-dimethyl-2-pyridinyl]thio]acetic acid propan-2-yl ester IUPAC Name: propan-2-yl 2-[3-[(4-ethylphenyl)carbamoyl]-4,6-dimethylpyridin-2-yl]sulfanylacetate Traditional Name: 2-[[3-[(4-ethylphenyl)carbamoyl]-4,6-dimethyl-2-pyridyl]thio]acetic acid isopropyl ester Formula: C21H26N2O3S MolecularWeight: 386.50774

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)OC(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)NC(=O)C2=C(N=C(C=C2C)C)SCC(=O)OC(C)C

InChI

InChI=1S/C21H26N2O3S/c1-6-16-7-9-17(10-8-16)23-20(25)19-14(4)11-15(5)22-21(19)27-12-18(24)26-13(2)3/h7-11,13H,6,12H2,1-5H3,(H,23,25)