6-bromanyl-2-[2-[(E)-[3-methyl-1-(3-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]hydrazinyl]-1H-quinazolin-4-one

Systemtic Name: 6-bromanyl-2-[2-[(E)-[3-methyl-1-(3-methylphenyl)-5-oxidanylidene-pyrazol-4-ylidene]methyl]hydrazinyl]-1H-quinazolin-4-one Openeye Name: 6-bromo-2-[2-[(E)-[3-methyl-1-(m-tolyl)-5-oxo-pyrazol-4-ylidene]methyl]hydrazino]-1H-quinazolin-4-one CAS Name: 6-bromo-2-[[(E)-[3-methyl-1-(3-methylphenyl)-5-oxo-4-pyrazolylidene]methyl]hydrazo]-1H-quinazolin-4-one IUPAC Name: 6-bromo-2-[2-[(E)-[3-methyl-1-(3-methylphenyl)-5-oxopyrazol-4-ylidene]methyl]hydrazinyl]-1H-quinazolin-4-one Traditional Name: 6-bromo-2-[N'-[(E)-[5-keto-3-methyl-1-(m-tolyl)-2-pyrazolin-4-ylidene]methyl]hydrazino]-1H-quinazolin-4-one Formula: C20H17BrN6O2 MolecularWeight: 453.29198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N2C(=O)C(=CNNC3=NC(=O)C4=C(N3)C=CC(=C4)Br)C(=N2)C

Isomeric SMILES

CC1=CC(=CC=C1)N2C(=O)/C(=C/NNC3=NC(=O)C4=C(N3)C=CC(=C4)Br)/C(=N2)C

InChI

InChI=1S/C20H17BrN6O2/c1-11-4-3-5-14(8-11)27-19(29)16(12(2)26-27)10-22-25-20-23-17-7-6-13(21)9-15(17)18(28)24-20/h3-10,22H,1-2H3,(H2,23,24,25,28)/b16-10+