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

Systemtic Name: ethyl N-[[6-(ethoxycarbonylcarbamothioylamino)-2-propyl-1H-benzimidazol-5-yl]carbamothioyl]carbamate Openeye Name: ethyl N-[[6-(ethoxycarbonylcarbamothioylamino)-2-propyl-1H-benzimidazol-5-yl]carbamothioyl]carbamate CAS Name: N-[[[6-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-2-propyl-1H-benzimidazol-5-yl]amino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[6-(ethoxycarbonylcarbamothioylamino)-2-propyl-1H-benzimidazol-5-yl]carbamothioyl]carbamate Traditional Name: N-[[6-(carbethoxythiocarbamoylamino)-2-propyl-1H-benzimidazol-5-yl]thiocarbamoyl]carbamic acid ethyl ester Formula: C18H24N6O4S2 MolecularWeight: 452.55096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=CC(=C(C=C2N1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

Isomeric SMILES

CCCC1=NC2=CC(=C(C=C2N1)NC(=S)NC(=O)OCC)NC(=S)NC(=O)OCC

InChI

InChI=1S/C18H24N6O4S2/c1-4-7-14-19-10-8-12(21-15(29)23-17(25)27-5-2)13(9-11(10)20-14)22-16(30)24-18(26)28-6-3/h8-9H,4-7H2,1-3H3,(H,19,20)(H2,21,23,25,29)(H2,22,24,26,30)