(phenylmethyl) N-[2-[[2-(methoxycarbonylcarbamothioylamino)-5-phenylsulfanyl-phenyl]amino]-2-oxidanylidene-ethyl]carbamate

Systemtic Name: (phenylmethyl) N-[2-[[2-(methoxycarbonylcarbamothioylamino)-5-phenylsulfanyl-phenyl]amino]-2-oxidanylidene-ethyl]carbamate Openeye Name: methyl N-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-phenylsulfanyl-phenyl]carbamothioyl]carbamate CAS Name: N-[2-[2-[[(methoxycarbonylamino)-sulfanylidenemethyl]amino]-5-(phenylthio)anilino]-2-oxoethyl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[2-[2-(methoxycarbonylcarbamothioylamino)-5-phenylsulfanylanilino]-2-oxoethyl]carbamate Traditional Name: N-[[2-[[2-(benzyloxycarbonylamino)acetyl]amino]-4-(phenylthio)phenyl]thiocarbamoyl]carbamic acid methyl ester Formula: C25H24N4O5S2 MolecularWeight: 524.61186

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=O)CNC(=O)OCC3=CC=CC=C3

Isomeric SMILES

COC(=O)NC(=S)NC1=C(C=C(C=C1)SC2=CC=CC=C2)NC(=O)CNC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C25H24N4O5S2/c1-33-25(32)29-23(35)28-20-13-12-19(36-18-10-6-3-7-11-18)14-21(20)27-22(30)15-26-24(31)34-16-17-8-4-2-5-9-17/h2-14H,15-16H2,1H3,(H,26,31)(H,27,30)(H2,28,29,32,35)