methyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate Openeye Name: methyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethyl-thiophene-3-carboxylate CAS Name: 2-[[3-[(4-methoxyphenyl)thio]-1-oxopropyl]amino]-4,5-dimethyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[3-(4-methoxyphenyl)sulfanylpropanoylamino]-4,5-dimethylthiophene-3-carboxylate Traditional Name: 2-[3-[(4-methoxyphenyl)thio]propanoylamino]-4,5-dimethyl-thiophene-3-carboxylic acid methyl ester Formula: C18H21NO4S2 MolecularWeight: 379.49364

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=O)CCSC2=CC=C(C=C2)OC)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=O)CCSC2=CC=C(C=C2)OC)C

InChI

InChI=1S/C18H21NO4S2/c1-11-12(2)25-17(16(11)18(21)23-4)19-15(20)9-10-24-14-7-5-13(22-3)6-8-14/h5-8H,9-10H2,1-4H3,(H,19,20)