N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide

Systemtic Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(2-methyl-4-oxidanylidene-quinazolin-3-yl)benzamide Openeye Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(2-methyl-4-oxo-quinazolin-3-yl)benzamide CAS Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(2-methyl-4-oxo-3-quinazolinyl)benzamide IUPAC Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(2-methyl-4-oxoquinazolin-3-yl)benzamide Traditional Name: N-[2-(1,3-benzothiazol-2-yl)phenyl]-4-(4-keto-2-methyl-quinazolin-3-yl)benzamide Formula: C29H20N4O2S MolecularWeight: 488.5597

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4C5=NC6=CC=CC=C6S5

Isomeric SMILES

CC1=NC2=CC=CC=C2C(=O)N1C3=CC=C(C=C3)C(=O)NC4=CC=CC=C4C5=NC6=CC=CC=C6S5

InChI

InChI=1S/C29H20N4O2S/c1-18-30-24-11-5-3-9-22(24)29(35)33(18)20-16-14-19(15-17-20)27(34)31-23-10-4-2-8-21(23)28-32-25-12-6-7-13-26(25)36-28/h2-17H,1H3,(H,31,34)