3-[(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one

Systemtic Name: 3-[(2,4-dimethyl-5-oxidanylidene-1-phenyl-pyrazol-3-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Openeye Name: 3-[(2,4-dimethyl-5-oxo-1-phenyl-pyrazol-3-yl)methyleneamino]-2-thioxo-1H-quinazolin-4-one CAS Name: 3-[(2,4-dimethyl-5-oxo-1-phenyl-3-pyrazolyl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one IUPAC Name: 3-[(2,4-dimethyl-5-oxo-1-phenylpyrazol-3-yl)methylideneamino]-2-sulfanylidene-1H-quinazolin-4-one Traditional Name: 3-[(5-keto-2,4-dimethyl-1-phenyl-3-pyrazolin-3-yl)methyleneamino]-2-thioxo-1H-quinazolin-4-one Formula: C20H17N5O2S MolecularWeight: 391.44628

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)C=NN3C(=O)C4=CC=CC=C4NC3=S

Isomeric SMILES

CC1=C(N(N(C1=O)C2=CC=CC=C2)C)C=NN3C(=O)C4=CC=CC=C4NC3=S

InChI

InChI=1S/C20H17N5O2S/c1-13-17(23(2)25(18(13)26)14-8-4-3-5-9-14)12-21-24-19(27)15-10-6-7-11-16(15)22-20(24)28/h3-12H,1-2H3,(H,22,28)