methyl 4-ethyl-5-methyl-2-[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiophene-3-carboxylate

Systemtic Name: methyl 4-ethyl-5-methyl-2-[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]ethanoylamino]thiophene-3-carboxylate Openeye Name: methyl 4-ethyl-5-methyl-2-[[2-[[4-propyl-5-(2-thienyl)-1,2,4-triazol-3-yl]sulfanyl]acetyl]amino]thiophene-3-carboxylate CAS Name: 4-ethyl-5-methyl-2-[[1-oxo-2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)thio]ethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 4-ethyl-5-methyl-2-[[2-[(4-propyl-5-thiophen-2-yl-1,2,4-triazol-3-yl)sulfanyl]acetyl]amino]thiophene-3-carboxylate Traditional Name: 4-ethyl-5-methyl-2-[[2-[[4-propyl-5-(2-thienyl)-1,2,4-triazol-3-yl]thio]acetyl]amino]thiophene-3-carboxylic acid methyl ester Formula: C20H24N4O3S3 MolecularWeight: 464.62456

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=C1SCC(=O)NC2=C(C(=C(S2)C)CC)C(=O)OC)C3=CC=CS3

Isomeric SMILES

CCCN1C(=NN=C1SCC(=O)NC2=C(C(=C(S2)C)CC)C(=O)OC)C3=CC=CS3

InChI

InChI=1S/C20H24N4O3S3/c1-5-9-24-17(14-8-7-10-28-14)22-23-20(24)29-11-15(25)21-18-16(19(26)27-4)13(6-2)12(3)30-18/h7-8,10H,5-6,9,11H2,1-4H3,(H,21,25)