methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(4-propoxyphenyl)carbonylamino]carbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(4-propoxyphenyl)carbonylamino]carbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(4-propoxybenzoyl)amino]carbamothioylamino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[[[oxo-(4-propoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[[(4-propoxybenzoyl)amino]carbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-4-methyl-2-[[(4-propoxybenzoyl)amino]thiocarbamoylamino]thiophene-3-carboxylic acid methyl ester Formula: C21H26N4O5S2 MolecularWeight: 478.58494

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OC

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NNC(=S)NC2=C(C(=C(S2)C(=O)N(C)C)C)C(=O)OC

InChI

InChI=1S/C21H26N4O5S2/c1-6-11-30-14-9-7-13(8-10-14)17(26)23-24-21(31)22-18-15(20(28)29-5)12(2)16(32-18)19(27)25(3)4/h7-10H,6,11H2,1-5H3,(H,23,26)(H2,22,24,31)