methyl N-[(E)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(2-phenylethanoylamino)-5-phenylsulfanyl-phenyl]carbamate

Systemtic Name: methyl N-[(E)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(2-phenylethanoylamino)-5-phenylsulfanyl-phenyl]carbamate Openeye Name: methyl N-[(E)-N'-methoxycarbonylcarbamimidoyl]-N-[2-[(2-phenylacetyl)amino]-5-phenylsulfanyl-phenyl]carbamate CAS Name: N-[(E)-amino(methoxycarbonylimino)methyl]-N-[2-[(1-oxo-2-phenylethyl)amino]-5-(phenylthio)phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[(E)-N'-methoxycarbonylcarbamimidoyl]-N-[2-[(2-phenylacetyl)amino]-5-phenylsulfanylphenyl]carbamate Traditional Name: N-[(E)-N'-carbomethoxyamidino]-N-[2-[(2-phenylacetyl)amino]-5-(phenylthio)phenyl]carbamic acid methyl ester Formula: C25H24N4O5S MolecularWeight: 492.54686

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)N=C(N)N(C1=C(C=CC(=C1)SC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)/N=C(\N)/N(C1=C(C=CC(=C1)SC2=CC=CC=C2)NC(=O)CC3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C25H24N4O5S/c1-33-24(31)28-23(26)29(25(32)34-2)21-16-19(35-18-11-7-4-8-12-18)13-14-20(21)27-22(30)15-17-9-5-3-6-10-17/h3-14,16H,15H2,1-2H3,(H,27,30)(H2,26,28,31)