methyl 5-ethyl-2-(3-methoxypropylcarbamothioylamino)thiophene-3-carboxylate

Systemtic Name: methyl 5-ethyl-2-(3-methoxypropylcarbamothioylamino)thiophene-3-carboxylate Openeye Name: methyl 5-ethyl-2-(3-methoxypropylcarbamothioylamino)thiophene-3-carboxylate CAS Name: 5-ethyl-2-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-ethyl-2-(3-methoxypropylcarbamothioylamino)thiophene-3-carboxylate Traditional Name: 5-ethyl-2-(3-methoxypropylthiocarbamoylamino)thiophene-3-carboxylic acid methyl ester Formula: C13H20N2O3S2 MolecularWeight: 316.4395

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(S1)NC(=S)NCCCOC)C(=O)OC

Isomeric SMILES

CCC1=CC(=C(S1)NC(=S)NCCCOC)C(=O)OC

InChI

InChI=1S/C13H20N2O3S2/c1-4-9-8-10(12(16)18-3)11(20-9)15-13(19)14-6-5-7-17-2/h8H,4-7H2,1-3H3,(H2,14,15,19)