ethyl 2-(3-chloranylpropanoylamino)-4-(4-ethoxyphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-(3-chloranylpropanoylamino)-4-(4-ethoxyphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-(3-chloropropanoylamino)-4-(4-ethoxyphenyl)thiophene-3-carboxylate CAS Name: 2-[(3-chloro-1-oxopropyl)amino]-4-(4-ethoxyphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(3-chloropropanoylamino)-4-(4-ethoxyphenyl)thiophene-3-carboxylate Traditional Name: 2-(3-chloropropanoylamino)-4-p-phenetyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20ClNO4S MolecularWeight: 381.8737

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCCl

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=CSC(=C2C(=O)OCC)NC(=O)CCCl

InChI

InChI=1S/C18H20ClNO4S/c1-3-23-13-7-5-12(6-8-13)14-11-25-17(20-15(21)9-10-19)16(14)18(22)24-4-2/h5-8,11H,3-4,9-10H2,1-2H3,(H,20,21)