6-[4-[(3-chloranyl-2-methyl-phenyl)amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[4-[(3-chloranyl-2-methyl-phenyl)amino]-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[4-(3-chloro-2-methyl-anilino)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[4-(3-chloro-2-methylanilino)-1H-quinazolin-2-ylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[4-(3-chloro-2-methylanilino)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[4-(3-chloro-2-methyl-anilino)-1H-quinazolin-2-ylidene]cyclohexa-2,4-dien-1-one Formula: C21H16ClN3O MolecularWeight: 361.82424

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)NC2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

Isomeric SMILES

CC1=C(C=CC=C1Cl)NC2=NC(=C3C=CC=CC3=O)NC4=CC=CC=C42

InChI

InChI=1S/C21H16ClN3O/c1-13-16(22)9-6-11-17(13)23-20-14-7-2-4-10-18(14)24-21(25-20)15-8-3-5-12-19(15)26/h2-12,24H,1H3,(H,23,25)