methyl N-[(Z)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(4-methylpentanoylamino)-5-phenylsulfanyl-phenyl]carbamate

Systemtic Name: methyl N-[(Z)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(4-methylpentanoylamino)-5-phenylsulfanyl-phenyl]carbamate Openeye Name: methyl N-[(Z)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(4-methylpentanoylamino)-5-phenylsulfanyl-phenyl]carbamate CAS Name: N-[(Z)-amino(methoxycarbonylimino)methyl]-N-[2-[(4-methyl-1-oxopentyl)amino]-5-(phenylthio)phenyl]carbamic acid methyl ester IUPAC Name: methyl N-[(Z)-N'-methoxycarbonylcarbamimidoyl]-N-[2-(4-methylpentanoylamino)-5-phenylsulfanylphenyl]carbamate Traditional Name: N-[(Z)-N'-carbomethoxyamidino]-N-[2-(4-methylpentanoylamino)-5-(phenylthio)phenyl]carbamic acid methyl ester Formula: C23H28N4O5S MolecularWeight: 472.55722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=C(C=C(C=C1)SC2=CC=CC=C2)N(C(=NC(=O)OC)N)C(=O)OC

Isomeric SMILES

CC(C)CCC(=O)NC1=C(C=C(C=C1)SC2=CC=CC=C2)N(/C(=N\C(=O)OC)/N)C(=O)OC

InChI

InChI=1S/C23H28N4O5S/c1-15(2)10-13-20(28)25-18-12-11-17(33-16-8-6-5-7-9-16)14-19(18)27(23(30)32-4)21(24)26-22(29)31-3/h5-9,11-12,14-15H,10,13H2,1-4H3,(H,25,28)(H2,24,26,29)