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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNC(=O)C3=CC=CO3

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNC(=O)C3=CC=CO3

InChI

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