ethyl 2-[2-(2-azanylidene-1,3-thiazol-3-yl)ethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate

Systemtic Name: ethyl 2-[2-(2-azanylidene-1,3-thiazol-3-yl)ethanoylamino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Openeye Name: ethyl 2-[[2-(2-iminothiazol-3-yl)acetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylate CAS Name: 2-[[2-(2-imino-3-thiazolyl)-1-oxoethyl]amino]-5-methyl-4-(4-methylphenyl)-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[[2-(2-imino-1,3-thiazol-3-yl)acetyl]amino]-5-methyl-4-(4-methylphenyl)thiophene-3-carboxylate Traditional Name: 2-[[2-(2-imino-4-thiazolin-3-yl)acetyl]amino]-5-methyl-4-(p-tolyl)thiophene-3-carboxylic acid ethyl ester Formula: C20H21N3O3S2 MolecularWeight: 415.52904

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CN3C=CSC3=N

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C2=CC=C(C=C2)C)C)NC(=O)CN3C=CSC3=N

InChI

InChI=1S/C20H21N3O3S2/c1-4-26-19(25)17-16(14-7-5-12(2)6-8-14)13(3)28-18(17)22-15(24)11-23-9-10-27-20(23)21/h5-10,21H,4,11H2,1-3H3,(H,22,24)