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

Systemtic Name: methyl 2-[(methoxycarbonylamino)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate Openeye Name: methyl 2-[(methoxycarbonylamino)carbamothioylamino]-5-phenyl-thiophene-3-carboxylate CAS Name: 2-[[(methoxycarbonylhydrazo)-sulfanylidenemethyl]amino]-5-phenyl-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 2-[(methoxycarbonylamino)carbamothioylamino]-5-phenylthiophene-3-carboxylate Traditional Name: 2-[(carbomethoxyamino)thiocarbamoylamino]-5-phenyl-thiophene-3-carboxylic acid methyl ester Formula: C15H15N3O4S2 MolecularWeight: 365.4273

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O4S2/c1-21-13(19)10-8-11(9-6-4-3-5-7-9)24-12(10)16-14(23)17-18-15(20)22-2/h3-8H,1-2H3,(H,18,20)(H2,16,17,23)