methyl N-[[2-ethyl-6-(methoxycarbonylcarbamothioylamino)-1H-benzimidazol-5-yl]carbamothioyl]carbamate

Systemtic Name: methyl N-[[2-ethyl-6-(methoxycarbonylcarbamothioylamino)-1H-benzimidazol-5-yl]carbamothioyl]carbamate Openeye Name: methyl N-[[2-ethyl-6-(methoxycarbonylcarbamothioylamino)-1H-benzimidazol-5-yl]carbamothioyl]carbamate CAS Name: N-[[[2-ethyl-6-[[(methoxycarbonylamino)-sulfanylidenemethyl]amino]-1H-benzimidazol-5-yl]amino]-sulfanylidenemethyl]carbamic acid methyl ester IUPAC Name: methyl N-[[2-ethyl-6-(methoxycarbonylcarbamothioylamino)-1H-benzimidazol-5-yl]carbamothioyl]carbamate Traditional Name: N-[[6-(carbomethoxythiocarbamoylamino)-2-ethyl-1H-benzimidazol-5-yl]thiocarbamoyl]carbamic acid methyl ester Formula: C15H18N6O4S2 MolecularWeight: 410.47122

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=CC(=C(C=C2N1)NC(=S)NC(=O)OC)NC(=S)NC(=O)OC

Isomeric SMILES

CCC1=NC2=CC(=C(C=C2N1)NC(=S)NC(=O)OC)NC(=S)NC(=O)OC

InChI

InChI=1S/C15H18N6O4S2/c1-4-11-16-7-5-9(18-12(26)20-14(22)24-2)10(6-8(7)17-11)19-13(27)21-15(23)25-3/h5-6H,4H2,1-3H3,(H,16,17)(H2,18,20,22,26)(H2,19,21,23,27)