N-[(4-methoxyphenyl)-sulfanyl-phosphinothioyl]oxy-4-nitro-N-propan-2-yl-benzamide

Systemtic Name: N-[(4-methoxyphenyl)-sulfanyl-phosphinothioyl]oxy-4-nitro-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-N-[(4-methoxyphenyl)-sulfanyl-phosphinothioyl]oxy-4-nitro-benzamide CAS Name: N-[mercapto-(4-methoxyphenyl)phosphinothioyl]oxy-4-nitro-N-propan-2-ylbenzamide IUPAC Name: N-[(4-methoxyphenyl)-sulfanylphosphinothioyl]oxy-4-nitro-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-N-[mercapto-(4-methoxyphenyl)thiophosphoryl]oxy-4-nitro-benzamide Formula: C17H19N2O5PS2 MolecularWeight: 426.446921

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])OP(=S)(C2=CC=C(C=C2)OC)S

Isomeric SMILES

CC(C)N(C(=O)C1=CC=C(C=C1)[N+](=O)[O-])OP(=S)(C2=CC=C(C=C2)OC)S

InChI

InChI=1S/C17H19N2O5PS2/c1-12(2)18(17(20)13-4-6-14(7-5-13)19(21)22)24-25(26,27)16-10-8-15(23-3)9-11-16/h4-12H,1-3H3,(H,26,27)