2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one

Systemtic Name: 2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one CAS Name: 2-[(6-ethoxy-4-methyl-2-quinazolinyl)amino]-6-[[(1-phenyl-5-tetrazolyl)thio]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(6-ethoxy-4-methylquinazolin-2-yl)amino]-6-[(1-phenyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one Traditional Name: 2-[(6-ethoxy-4-methyl-quinazolin-2-yl)amino]-6-[[(1-phenyltetrazol-5-yl)thio]methyl]-1H-pyrimidin-4-one Formula: C23H21N9O2S MolecularWeight: 487.53694

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=NN=NN4C5=CC=CC=C5

Isomeric SMILES

CCOC1=CC2=C(C=C1)N=C(N=C2C)NC3=NC(=O)C=C(N3)CSC4=NN=NN4C5=CC=CC=C5

InChI

InChI=1S/C23H21N9O2S/c1-3-34-17-9-10-19-18(12-17)14(2)24-21(26-19)28-22-25-15(11-20(33)27-22)13-35-23-29-30-31-32(23)16-7-5-4-6-8-16/h4-12H,3,13H2,1-2H3,(H2,24,25,26,27,28,33)