methyl 5-[(4-methoxyphenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate

Systemtic Name: methyl 5-[(4-methoxyphenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate Openeye Name: methyl 5-[(4-methoxyphenyl)methylcarbamothioylamino]-3-methyl-thiophene-2-carboxylate CAS Name: 5-[[[(4-methoxyphenyl)methylamino]-sulfanylidenemethyl]amino]-3-methyl-2-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-[(4-methoxyphenyl)methylcarbamothioylamino]-3-methylthiophene-2-carboxylate Traditional Name: 3-methyl-5-(p-anisylthiocarbamoylamino)thiophene-2-carboxylic acid methyl ester Formula: C16H18N2O3S2 MolecularWeight: 350.45572

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1)NC(=S)NCC2=CC=C(C=C2)OC)C(=O)OC

Isomeric SMILES

CC1=C(SC(=C1)NC(=S)NCC2=CC=C(C=C2)OC)C(=O)OC

InChI

InChI=1S/C16H18N2O3S2/c1-10-8-13(23-14(10)15(19)21-3)18-16(22)17-9-11-4-6-12(20-2)7-5-11/h4-8H,9H2,1-3H3,(H2,17,18,22)