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

Systemtic Name: methyl 5-phenyl-2-[(thiophen-2-ylcarbonylamino)carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-phenyl-2-[(thiophene-2-carbonylamino)carbamothioylamino]thiophene-3-carboxylate CAS Name: 2-[[[[oxo(thiophen-2-yl)methyl]hydrazo]-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-phenyl-2-[(thiophene-2-carbonylamino)carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-phenyl-2-[(2-thenoylamino)thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C18H15N3O3S3 MolecularWeight: 417.525

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNC(=O)C3=CC=CS3

Isomeric SMILES

COC(=O)C1=C(SC(=C1)C2=CC=CC=C2)NC(=S)NNC(=O)C3=CC=CS3

InChI

InChI=1S/C18H15N3O3S3/c1-24-17(23)12-10-14(11-6-3-2-4-7-11)27-16(12)19-18(25)21-20-15(22)13-8-5-9-26-13/h2-10H,1H3,(H,20,22)(H2,19,21,25)