1-methyl-1-oxidanylidene-2-propan-2-yl-7-pyridin-2-ylsulfanyl-4H-2,4,1$l^{5}-benzodiazaphosphinin-3-one

Systemtic Name: 1-methyl-1-oxidanylidene-2-propan-2-yl-7-pyridin-2-ylsulfanyl-4H-2,4,1$l^{5}-benzodiazaphosphinin-3-one Openeye Name: 2-isopropyl-1-methyl-1-oxo-7-(2-pyridylsulfanyl)-4H-2,4,1$l^{5}-benzodiazaphosphinin-3-one CAS Name: 1-methyl-1-oxo-2-propan-2-yl-7-(2-pyridinylthio)-4H-2,4,1$l^{5}-benzodiazaphosphorin-3-one IUPAC Name: 1-methyl-1-oxo-2-propan-2-yl-7-pyridin-2-ylsulfanyl-4H-2,4,1$l^{5}-benzodiazaphosphinin-3-one Traditional Name: 2-isopropyl-1-keto-1-methyl-7-(2-pyridylthio)-4H-2,4,1$l^{5}-benzodiazaphosphorin-3-one Formula: C16H18N3O2PS MolecularWeight: 347.371781

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=O)NC2=C(P1(=O)C)C=C(C=C2)SC3=CC=CC=N3

Isomeric SMILES

CC(C)N1C(=O)NC2=C(P1(=O)C)C=C(C=C2)SC3=CC=CC=N3

InChI

InChI=1S/C16H18N3O2PS/c1-11(2)19-16(20)18-13-8-7-12(10-14(13)22(19,3)21)23-15-6-4-5-9-17-15/h4-11H,1-3H3,(H,18,20)