N-[7-chloranyl-2-methyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-6-yl]pentanamide

Systemtic Name: N-[7-chloranyl-2-methyl-4-oxidanylidene-3-(phenylmethyl)quinazolin-6-yl]pentanamide Openeye Name: N-(3-benzyl-7-chloro-2-methyl-4-oxo-quinazolin-6-yl)pentanamide CAS Name: N-[7-chloro-2-methyl-4-oxo-3-(phenylmethyl)-6-quinazolinyl]pentanamide IUPAC Name: N-(3-benzyl-7-chloro-2-methyl-4-oxoquinazolin-6-yl)pentanamide Traditional Name: N-(3-benzyl-7-chloro-4-keto-2-methyl-quinazolin-6-yl)valeramide Formula: C21H22ClN3O2 MolecularWeight: 383.87128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C2C(=C1)C(=O)N(C(=N2)C)CC3=CC=CC=C3)Cl

Isomeric SMILES

CCCCC(=O)NC1=C(C=C2C(=C1)C(=O)N(C(=N2)C)CC3=CC=CC=C3)Cl

InChI

InChI=1S/C21H22ClN3O2/c1-3-4-10-20(26)24-19-11-16-18(12-17(19)22)23-14(2)25(21(16)27)13-15-8-6-5-7-9-15/h5-9,11-12H,3-4,10,13H2,1-2H3,(H,24,26)