4-[[1-methyl-4-(2-nitrophenyl)sulfanyl-pyrrol-2-yl]-morpholin-4-yl-phosphoryl]morpholine

Systemtic Name: 4-[[1-methyl-4-(2-nitrophenyl)sulfanyl-pyrrol-2-yl]-morpholin-4-yl-phosphoryl]morpholine Openeye Name: 4-[[1-methyl-4-(2-nitrophenyl)sulfanyl-pyrrol-2-yl]-morpholino-phosphoryl]morpholine CAS Name: 4-[[1-methyl-4-[(2-nitrophenyl)thio]-2-pyrrolyl]-(4-morpholinyl)phosphoryl]morpholine IUPAC Name: 4-[[1-methyl-4-(2-nitrophenyl)sulfanylpyrrol-2-yl]-morpholin-4-ylphosphoryl]morpholine Traditional Name: 4-[[1-methyl-4-[(2-nitrophenyl)thio]pyrrol-2-yl]-morpholino-phosphoryl]morpholine Formula: C19H25N4O5PS MolecularWeight: 452.464361

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1P(=O)(N2CCOCC2)N3CCOCC3)SC4=CC=CC=C4[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1P(=O)(N2CCOCC2)N3CCOCC3)SC4=CC=CC=C4[N+](=O)[O-]

InChI

InChI=1S/C19H25N4O5PS/c1-20-15-16(30-18-5-3-2-4-17(18)23(24)25)14-19(20)29(26,21-6-10-27-11-7-21)22-8-12-28-13-9-22/h2-5,14-15H,6-13H2,1H3