N-methyl-N-[[methyl-(4-nitrophenyl)sulfanyl-amino]-propylsulfanyl-phosphoryl]heptanethioamide

Systemtic Name: N-methyl-N-[[methyl-(4-nitrophenyl)sulfanyl-amino]-propylsulfanyl-phosphoryl]heptanethioamide Openeye Name: N-methyl-N-[[methyl-(4-nitrophenyl)sulfanyl-amino]-propylsulfanyl-phosphoryl]heptanethioamide CAS Name: N-methyl-N-[[methyl-[(4-nitrophenyl)thio]amino]-(propylthio)phosphoryl]heptanethioamide IUPAC Name: N-methyl-N-[[methyl-(4-nitrophenyl)sulfanylamino]-propylsulfanylphosphoryl]heptanethioamide Traditional Name: N-methyl-N-[[methyl-[(4-nitrophenyl)thio]amino]-(propylthio)phosphoryl]thioenanthamide Formula: C18H30N3O3PS3 MolecularWeight: 463.617861

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(=S)N(C)P(=O)(N(C)SC1=CC=C(C=C1)[N+](=O)[O-])SCCC

Isomeric SMILES

CCCCCCC(=S)N(C)P(=O)(N(C)SC1=CC=C(C=C1)[N+](=O)[O-])SCCC

InChI

InChI=1S/C18H30N3O3PS3/c1-5-7-8-9-10-18(26)19(3)25(24,27-15-6-2)20(4)28-17-13-11-16(12-14-17)21(22)23/h11-14H,5-10,15H2,1-4H3