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

Systemtic Name: methyl 2-(3-methoxypropylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate Openeye Name: methyl 2-(3-methoxypropylcarbamothioylamino)-5-methyl-thiophene-3-carboxylate CAS Name: 2-[[(3-methoxypropylamino)-sulfanylidenemethyl]amino]-5-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-(3-methoxypropylcarbamothioylamino)-5-methylthiophene-3-carboxylate Traditional Name: 2-(3-methoxypropylthiocarbamoylamino)-5-methyl-thiophene-3-carboxylic acid methyl ester Formula: C12H18N2O3S2 MolecularWeight: 302.41292

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)NC(=S)NCCCOC)C(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)NC(=S)NCCCOC)C(=O)OC

InChI

InChI=1S/C12H18N2O3S2/c1-8-7-9(11(15)17-3)10(19-8)14-12(18)13-5-4-6-16-2/h7H,4-6H2,1-3H3,(H2,13,14,18)