4-chloranyl-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide

Systemtic Name: 4-chloranyl-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxidanylidene-quinazolin-2-yl]ethyl]benzamide Openeye Name: 4-chloro-N-isopentyl-N-[1-[4-oxo-3-(p-tolyl)quinazolin-2-yl]ethyl]benzamide CAS Name: 4-chloro-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxo-2-quinazolinyl]ethyl]benzamide IUPAC Name: 4-chloro-N-(3-methylbutyl)-N-[1-[3-(4-methylphenyl)-4-oxoquinazolin-2-yl]ethyl]benzamide Traditional Name: 4-chloro-N-isoamyl-N-[1-[4-keto-3-(p-tolyl)quinazolin-2-yl]ethyl]benzamide Formula: C29H30ClN3O2 MolecularWeight: 488.0204

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2C(C)N(CCC(C)C)C(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C29H30ClN3O2/c1-19(2)17-18-32(28(34)22-11-13-23(30)14-12-22)21(4)27-31-26-8-6-5-7-25(26)29(35)33(27)24-15-9-20(3)10-16-24/h5-16,19,21H,17-18H2,1-4H3