[1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] 4-ethyl-5-propyl-thiophene-2-carboxylate

Systemtic Name: [1-[(2-chloranylpyridin-3-yl)amino]-1-oxidanylidene-propan-2-yl] 4-ethyl-5-propyl-thiophene-2-carboxylate Openeye Name: [2-[(2-chloro-3-pyridyl)amino]-1-methyl-2-oxo-ethyl] 4-ethyl-5-propyl-thiophene-2-carboxylate CAS Name: 4-ethyl-5-propyl-2-thiophenecarboxylic acid [1-[(2-chloro-3-pyridinyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(2-chloropyridin-3-yl)amino]-1-oxopropan-2-yl] 4-ethyl-5-propylthiophene-2-carboxylate Traditional Name: 4-ethyl-5-propyl-thiophene-2-carboxylic acid [2-[(2-chloro-3-pyridyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C18H21ClN2O3S MolecularWeight: 380.88894

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=C(S1)C(=O)OC(C)C(=O)NC2=C(N=CC=C2)Cl)CC

Isomeric SMILES

CCCC1=C(C=C(S1)C(=O)OC(C)C(=O)NC2=C(N=CC=C2)Cl)CC

InChI

InChI=1S/C18H21ClN2O3S/c1-4-7-14-12(5-2)10-15(25-14)18(23)24-11(3)17(22)21-13-8-6-9-20-16(13)19/h6,8-11H,4-5,7H2,1-3H3,(H,21,22)