6-chloranyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[(4-methyl-6-phenyl-pyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[[(4-methyl-6-phenyl-2-pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[(4-methyl-6-phenylpyrimidin-2-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[[(4-methyl-6-phenyl-pyrimidin-2-yl)thio]methyl]-1H-quinazolin-4-one Formula: C20H15ClN4OS MolecularWeight: 394.8773

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

Isomeric SMILES

CC1=NC(=NC(=C1)C2=CC=CC=C2)SCC3=NC(=O)C4=C(N3)C=CC(=C4)Cl

InChI

InChI=1S/C20H15ClN4OS/c1-12-9-17(13-5-3-2-4-6-13)24-20(22-12)27-11-18-23-16-8-7-14(21)10-15(16)19(26)25-18/h2-10H,11H2,1H3,(H,23,25,26)