methyl 5-(dimethylcarbamoyl)-4-methyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate

Systemtic Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[3-(2-oxidanylidenepyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate Openeye Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[3-(2-oxopyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate CAS Name: 5-[dimethylamino(oxo)methyl]-4-methyl-2-[[[3-(2-oxo-1-pyrrolidinyl)propylamino]-sulfanylidenemethyl]amino]-3-thiophenecarboxylic acid methyl ester IUPAC Name: methyl 5-(dimethylcarbamoyl)-4-methyl-2-[3-(2-oxopyrrolidin-1-yl)propylcarbamothioylamino]thiophene-3-carboxylate Traditional Name: 5-(dimethylcarbamoyl)-2-[3-(2-ketopyrrolidino)propylthiocarbamoylamino]-4-methyl-thiophene-3-carboxylic acid methyl ester Formula: C18H26N4O4S2 MolecularWeight: 426.55344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=C1C(=O)OC)NC(=S)NCCCN2CCCC2=O)C(=O)N(C)C

Isomeric SMILES

CC1=C(SC(=C1C(=O)OC)NC(=S)NCCCN2CCCC2=O)C(=O)N(C)C

InChI

InChI=1S/C18H26N4O4S2/c1-11-13(17(25)26-4)15(28-14(11)16(24)21(2)3)20-18(27)19-8-6-10-22-9-5-7-12(22)23/h5-10H2,1-4H3,(H2,19,20,27)