2-[(Z)-(1,5-dimethyl-2-oxidanylidene-indol-3-ylidene)methyl]-6-iodanyl-3-(phenylmethyl)quinazolin-4-one

Systemtic Name: 2-[(Z)-(1,5-dimethyl-2-oxidanylidene-indol-3-ylidene)methyl]-6-iodanyl-3-(phenylmethyl)quinazolin-4-one Openeye Name: 3-benzyl-2-[(Z)-(1,5-dimethyl-2-oxo-indolin-3-ylidene)methyl]-6-iodo-quinazolin-4-one CAS Name: 2-[(Z)-(1,5-dimethyl-2-oxo-3-indolylidene)methyl]-6-iodo-3-(phenylmethyl)-4-quinazolinone IUPAC Name: 3-benzyl-2-[(Z)-(1,5-dimethyl-2-oxoindol-3-ylidene)methyl]-6-iodoquinazolin-4-one Traditional Name: 3-benzyl-6-iodo-2-[(Z)-(2-keto-1,5-dimethyl-indolin-3-ylidene)methyl]quinazolin-4-one Formula: C26H20IN3O2 MolecularWeight: 533.36037

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)C2=CC3=NC4=C(C=C(C=C4)I)C(=O)N3CC5=CC=CC=C5)C

Isomeric SMILES

CC1=CC\2=C(C=C1)N(C(=O)/C2=C\C3=NC4=C(C=C(C=C4)I)C(=O)N3CC5=CC=CC=C5)C

InChI

InChI=1S/C26H20IN3O2/c1-16-8-11-23-19(12-16)20(25(31)29(23)2)14-24-28-22-10-9-18(27)13-21(22)26(32)30(24)15-17-6-4-3-5-7-17/h3-14H,15H2,1-2H3/b20-14-