6-[(4-chlorophenyl)sulfanylmethyl]-2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-4-one

Systemtic Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-4-one Openeye Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-4-one CAS Name: 6-[[(4-chlorophenyl)thio]methyl]-2-[(8-ethoxy-4-methyl-2-quinazolinyl)amino]-1H-pyrimidin-4-one IUPAC Name: 6-[(4-chlorophenyl)sulfanylmethyl]-2-[(8-ethoxy-4-methylquinazolin-2-yl)amino]-1H-pyrimidin-4-one Traditional Name: 6-[[(4-chlorophenyl)thio]methyl]-2-[(8-ethoxy-4-methyl-quinazolin-2-yl)amino]-1H-pyrimidin-4-one Formula: C22H20ClN5O2S MolecularWeight: 453.9445

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC1=CC=CC2=C1N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=CC=C(C=C4)Cl

InChI

InChI=1S/C22H20ClN5O2S/c1-3-30-18-6-4-5-17-13(2)24-21(27-20(17)18)28-22-25-15(11-19(29)26-22)12-31-16-9-7-14(23)8-10-16/h4-11H,3,12H2,1-2H3,(H2,24,25,26,27,28,29)