methyl 5-(dimethylcarbamoyl)-2-(furan-2-ylmethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-2-(furan-2-ylmethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-2-(2-furylmethylcarbamothioylamino)-4-methyl-thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-2-[[(2-furanylmethylamino)-sulfanylidenemethyl]amino]-4-methyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-2-(furan-2-ylmethylcarbamothioylamino)-4-methylthiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-(2-furfurylthiocarbamoylamino)-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C16H19N3O4S2 MolecularWeight: 381.46976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CC=CO2)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NCC2=CC=CO2)C(=O)N(C)C

InChI

InChI=1S/C16H19N3O4S2/c1-9-11(15(21)22-4)13(25-12(9)14(20)19(2)3)18-16(24)17-8-10-6-5-7-23-10/h5-7H,8H2,1-4H3,(H2,17,18,24)