methyl 5-[[butan-2-ylsulfanyl-[ethyl(phenyliminomethyl)amino]phosphoryl]amino]pentanoate

Systemtic Name: methyl 5-[[butan-2-ylsulfanyl-[ethyl(phenyliminomethyl)amino]phosphoryl]amino]pentanoate Openeye Name: methyl 5-[[[ethyl(phenyliminomethyl)amino]-sec-butylsulfanyl-phosphoryl]amino]pentanoate CAS Name: 5-[[(butan-2-ylthio)-[ethyl(phenyliminomethyl)amino]phosphoryl]amino]pentanoic acid methyl ester IUPAC Name: methyl 5-[[butan-2-ylsulfanyl-[ethyl(phenyliminomethyl)amino]phosphoryl]amino]pentanoate Traditional Name: 5-[[[ethyl(phenyliminomethyl)amino]-(sec-butylthio)phosphoryl]amino]valeric acid methyl ester Formula: C19H32N3O3PS MolecularWeight: 413.514441

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)SP(=O)(NCCCCC(=O)OC)N(CC)C=NC1=CC=CC=C1

Isomeric SMILES

CCC(C)SP(=O)(NCCCCC(=O)OC)N(CC)C=NC1=CC=CC=C1

InChI

InChI=1S/C19H32N3O3PS/c1-5-17(3)27-26(24,21-15-11-10-14-19(23)25-4)22(6-2)16-20-18-12-8-7-9-13-18/h7-9,12-13,16-17H,5-6,10-11,14-15H2,1-4H3,(H,21,24)