ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-phenylsulfanyl-phenyl]carbamothioyl]carbamate

Systemtic Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-phenylsulfanyl-phenyl]carbamothioyl]carbamate Openeye Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-phenylsulfanyl-phenyl]carbamothioyl]carbamate CAS Name: N-[[2-[[(ethoxycarbonylamino)-sulfanylidenemethyl]amino]-4-(phenylthio)anilino]-sulfanylidenemethyl]carbamic acid ethyl ester IUPAC Name: ethyl N-[[2-(ethoxycarbonylcarbamothioylamino)-4-phenylsulfanylphenyl]carbamothioyl]carbamate Traditional Name: N-[[2-(carbethoxythiocarbamoylamino)-4-(phenylthio)phenyl]thiocarbamoyl]carbamic acid ethyl ester Formula: C20H22N4O4S3 MolecularWeight: 478.60808

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=S)NC(=O)OCC

Isomeric SMILES

CCOC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=S)NC(=O)OCC

InChI

InChI=1S/C20H22N4O4S3/c1-3-27-19(25)23-17(29)21-15-11-10-14(31-13-8-6-5-7-9-13)12-16(15)22-18(30)24-20(26)28-4-2/h5-12H,3-4H2,1-2H3,(H2,21,23,25,29)(H2,22,24,26,30)