ethyl 2-(4-chloranylbutanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: ethyl 2-(4-chloranylbutanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: ethyl 2-(4-chlorobutanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(4-chloro-1-oxobutyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(4-chlorobutanoylamino)-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-(4-chlorobutanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylic acid ethyl ester Formula: C18H20ClNO3S MolecularWeight: 365.8743

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)CCCCl

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=CC=C2)C)NC(=O)CCCCl

InChI

InChI=1S/C18H20ClNO3S/c1-3-23-18(22)16-15(13-8-5-4-6-9-13)12(2)24-17(16)20-14(21)10-7-11-19/h4-6,8-9H,3,7,10-11H2,1-2H3,(H,20,21)