2-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(2-propan-2-ylpyrazol-3-yl)quinazolin-4-one

Systemtic Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(2-propan-2-ylpyrazol-3-yl)quinazolin-4-one Openeye Name: 3-(2-isopropylpyrazol-3-yl)-2-[(1-methylimidazol-2-yl)sulfanylmethyl]quinazolin-4-one CAS Name: 2-[[(1-methyl-2-imidazolyl)thio]methyl]-3-(2-propan-2-yl-3-pyrazolyl)-4-quinazolinone IUPAC Name: 2-[(1-methylimidazol-2-yl)sulfanylmethyl]-3-(2-propan-2-ylpyrazol-3-yl)quinazolin-4-one Traditional Name: 3-(2-isopropylpyrazol-3-yl)-2-[[(1-methylimidazol-2-yl)thio]methyl]quinazolin-4-one Formula: C19H20N6OS MolecularWeight: 380.4667

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=CC=N1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NC=CN4C

Isomeric SMILES

CC(C)N1C(=CC=N1)N2C(=NC3=CC=CC=C3C2=O)CSC4=NC=CN4C

InChI

InChI=1S/C19H20N6OS/c1-13(2)25-17(8-9-21-25)24-16(12-27-19-20-10-11-23(19)3)22-15-7-5-4-6-14(15)18(24)26/h4-11,13H,12H2,1-3H3