3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one

Systemtic Name: 3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methylideneamino]-2-methyl-quinazolin-4-one Openeye Name: 3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-methyl-quinazolin-4-one CAS Name: 3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-4-pyrazolyl]methylideneamino]-2-methyl-4-quinazolinone IUPAC Name: 3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenylpyrazol-4-yl]methylideneamino]-2-methylquinazolin-4-one Traditional Name: 3-[(E)-[3-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-phenyl-pyrazol-4-yl]methyleneamino]-2-methyl-quinazolin-4-one Formula: C27H21N5O3 MolecularWeight: 463.48734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1N=CC3=CN(N=C3C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1/N=C/C3=CN(N=C3C4=CC5=C(C=C4)OCCO5)C6=CC=CC=C6

InChI

InChI=1S/C27H21N5O3/c1-18-29-23-10-6-5-9-22(23)27(33)32(18)28-16-20-17-31(21-7-3-2-4-8-21)30-26(20)19-11-12-24-25(15-19)35-14-13-34-24/h2-12,15-17H,13-14H2,1H3/b28-16+