N-methyl-N'-phenyl-N-[propoxy(propylsulfanyl)phosphoryl]azepane-1-carboximidamide

Systemtic Name: N-methyl-N'-phenyl-N-[propoxy(propylsulfanyl)phosphoryl]azepane-1-carboximidamide Openeye Name: N-methyl-N'-phenyl-N-[propoxy(propylsulfanyl)phosphoryl]azepane-1-carboxamidine CAS Name: N-methyl-N'-phenyl-N-[propoxy-(propylthio)phosphoryl]-1-azepanecarboximidamide IUPAC Name: N-methyl-N'-phenyl-N-[propoxy(propylsulfanyl)phosphoryl]azepane-1-carboximidamide Traditional Name: N-methyl-N'-phenyl-N-[propoxy-(propylthio)phosphoryl]azepane-1-carboxamidine Formula: C20H34N3O2PS MolecularWeight: 411.541621

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Descriptors Computed from Structure

Canonical SMILES:

CCCOP(=O)(N(C)C(=NC1=CC=CC=C1)N2CCCCCC2)SCCC

Isomeric SMILES

CCCOP(=O)(N(C)C(=NC1=CC=CC=C1)N2CCCCCC2)SCCC

InChI

InChI=1S/C20H34N3O2PS/c1-4-17-25-26(24,27-18-5-2)22(3)20(21-19-13-9-8-10-14-19)23-15-11-6-7-12-16-23/h8-10,13-14H,4-7,11-12,15-18H2,1-3H3