4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide

Systemtic Name: 4-(6,7-dimethoxy-4-oxidanylidene-quinazolin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide Openeye Name: 4-(6,7-dimethoxy-4-oxo-quinazolin-3-yl)-N-[[4-(isopropylcarbamoylamino)phenyl]methyl]butanamide CAS Name: 4-(6,7-dimethoxy-4-oxo-3-quinazolinyl)-N-[[4-[[oxo-(propan-2-ylamino)methyl]amino]phenyl]methyl]butanamide IUPAC Name: 4-(6,7-dimethoxy-4-oxoquinazolin-3-yl)-N-[[4-(propan-2-ylcarbamoylamino)phenyl]methyl]butanamide Traditional Name: N-[4-(isopropylcarbamoylamino)benzyl]-4-(4-keto-6,7-dimethoxy-quinazolin-3-yl)butyramide Formula: C25H31N5O5 MolecularWeight: 481.54414

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

Isomeric SMILES

CC(C)NC(=O)NC1=CC=C(C=C1)CNC(=O)CCCN2C=NC3=CC(=C(C=C3C2=O)OC)OC

InChI

InChI=1S/C25H31N5O5/c1-16(2)28-25(33)29-18-9-7-17(8-10-18)14-26-23(31)6-5-11-30-15-27-20-13-22(35-4)21(34-3)12-19(20)24(30)32/h7-10,12-13,15-16H,5-6,11,14H2,1-4H3,(H,26,31)(H2,28,29,33)