methyl 2-(3-chloranylpropanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-(3-chloranylpropanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-(3-chloropropanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[(3-chloro-1-oxopropyl)amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-chloropropanoylamino)-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-(3-chloropropanoylamino)-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C16H16ClNO3S MolecularWeight: 337.82114

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=O)CCCl)C(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1=C(C(=C(S1)NC(=O)CCCl)C(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H16ClNO3S/c1-10-13(11-6-4-3-5-7-11)14(16(20)21-2)15(22-10)18-12(19)8-9-17/h3-7H,8-9H2,1-2H3,(H,18,19)