(5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone

Systemtic Name: (5-chloranyl-2-methylsulfanyl-pyrimidin-4-yl)-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone Openeye Name: (5-chloro-2-methylsulfanyl-pyrimidin-4-yl)-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone CAS Name: [5-chloro-2-(methylthio)-4-pyrimidinyl]-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone IUPAC Name: (5-chloro-2-methylsulfanylpyrimidin-4-yl)-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone Traditional Name: [5-chloro-2-(methylthio)pyrimidin-4-yl]-(2,3-dihydro-1,4-benzoxazin-4-yl)methanone Formula: C14H12ClN3O2S MolecularWeight: 321.78198

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=NC=C(C(=N1)C(=O)N2CCOC3=CC=CC=C32)Cl

Isomeric SMILES

CSC1=NC=C(C(=N1)C(=O)N2CCOC3=CC=CC=C32)Cl

InChI

InChI=1S/C14H12ClN3O2S/c1-21-14-16-8-9(15)12(17-14)13(19)18-6-7-20-11-5-3-2-4-10(11)18/h2-5,8H,6-7H2,1H3