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

Systemtic Name: methyl N-(2-formamido-5-phenylsulfanyl-phenyl)-N-[(E)-N'-methoxycarbonylcarbamimidoyl]carbamate Openeye Name: methyl N-(2-formamido-5-phenylsulfanyl-phenyl)-N-[(E)-N'-methoxycarbonylcarbamimidoyl]carbamate CAS Name: N-[(E)-amino(methoxycarbonylimino)methyl]-N-[2-formamido-5-(phenylthio)phenyl]carbamic acid methyl ester IUPAC Name: methyl N-(2-formamido-5-phenylsulfanylphenyl)-N-[(E)-N'-methoxycarbonylcarbamimidoyl]carbamate Traditional Name: N-[(E)-N'-carbomethoxyamidino]-N-[2-formamido-5-(phenylthio)phenyl]carbamic acid methyl ester Formula: C18H18N4O5S MolecularWeight: 402.42432

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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)C(=O)OC

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O5S/c1-26-17(24)21-16(19)22(18(25)27-2)15-10-13(8-9-14(15)20-11-23)28-12-6-4-3-5-7-12/h3-11H,1-2H3,(H,20,23)(H2,19,21,24)