4-(4-chloranyl-3-methyl-phenoxy)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide

Systemtic Name: 4-(4-chloranyl-3-methyl-phenoxy)-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide Openeye Name: N-benzyl-4-(4-chloro-3-methyl-phenoxy)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide CAS Name: 4-(4-chloro-3-methylphenoxy)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-N-(phenylmethyl)butanamide IUPAC Name: N-benzyl-4-(4-chloro-3-methylphenoxy)-N-[(4-oxo-1H-quinazolin-2-yl)methyl]butanamide Traditional Name: N-benzyl-4-(4-chloro-3-methyl-phenoxy)-N-[(4-keto-1H-quinazolin-2-yl)methyl]butyramide Formula: C27H26ClN3O3 MolecularWeight: 475.96664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)OCCCC(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)Cl

Isomeric SMILES

CC1=C(C=CC(=C1)OCCCC(=O)N(CC2=CC=CC=C2)CC3=NC(=O)C4=CC=CC=C4N3)Cl

InChI

InChI=1S/C27H26ClN3O3/c1-19-16-21(13-14-23(19)28)34-15-7-12-26(32)31(17-20-8-3-2-4-9-20)18-25-29-24-11-6-5-10-22(24)27(33)30-25/h2-6,8-11,13-14,16H,7,12,15,17-18H2,1H3,(H,29,30,33)