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

Systemtic Name: 2-[(4-methylquinazolin-2-yl)amino]-6-[(1-methyl-1,2,3,4-tetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one Openeye Name: 2-[(4-methylquinazolin-2-yl)amino]-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one CAS Name: 2-[(4-methyl-2-quinazolinyl)amino]-6-[[(1-methyl-5-tetrazolyl)thio]methyl]-1H-pyrimidin-4-one IUPAC Name: 2-[(4-methylquinazolin-2-yl)amino]-6-[(1-methyltetrazol-5-yl)sulfanylmethyl]-1H-pyrimidin-4-one Traditional Name: 2-[(4-methylquinazolin-2-yl)amino]-6-[[(1-methyltetrazol-5-yl)thio]methyl]-1H-pyrimidin-4-one Formula: C16H15N9OS MolecularWeight: 381.415

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CSC4=NN=NN4C

Isomeric SMILES

CC1=NC(=NC2=CC=CC=C12)NC3=NC(=O)C=C(N3)CSC4=NN=NN4C

InChI

InChI=1S/C16H15N9OS/c1-9-11-5-3-4-6-12(11)19-14(17-9)21-15-18-10(7-13(26)20-15)8-27-16-22-23-24-25(16)2/h3-7H,8H2,1-2H3,(H2,17,18,19,20,21,26)