methyl 2-[(furan-2-ylcarbonylamino)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate

Systemtic Name: methyl 2-[(furan-2-ylcarbonylamino)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(furan-2-carbonylamino)carbamothioylamino]-5-methyl-4-phenyl-thiophene-3-carboxylate CAS Name: 2-[[[[2-furanyl(oxo)methyl]hydrazo]-sulfanylidenemethyl]amino]-5-methyl-4-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(furan-2-carbonylamino)carbamothioylamino]-5-methyl-4-phenylthiophene-3-carboxylate Traditional Name: 2-[(2-furoylamino)thiocarbamoylamino]-5-methyl-4-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C19H17N3O4S2 MolecularWeight: 415.48598

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(S1)NC(=S)NNC(=O)C2=CC=CO2)C(=O)OC)C3=CC=CC=C3

Isomeric SMILES

CC1=C(C(=C(S1)NC(=S)NNC(=O)C2=CC=CO2)C(=O)OC)C3=CC=CC=C3

InChI

InChI=1S/C19H17N3O4S2/c1-11-14(12-7-4-3-5-8-12)15(18(24)25-2)17(28-11)20-19(27)22-21-16(23)13-9-6-10-26-13/h3-10H,1-2H3,(H,21,23)(H2,20,22,27)