N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-3-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-(3-methyl-4-pyrrolidin-1-yl-phenyl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[3-methyl-4-(1-pyrrolidinyl)phenyl]-3-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-(3-methyl-4-pyrrolidin-1-ylphenyl)-3-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: 3-(4-keto-1H-quinazolin-2-yl)-N-(3-methyl-4-pyrrolidino-phenyl)propionamide Formula: C22H24N4O2 MolecularWeight: 376.45156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)N4CCCC4

Isomeric SMILES

CC1=C(C=CC(=C1)NC(=O)CCC2=NC(=O)C3=CC=CC=C3N2)N4CCCC4

InChI

InChI=1S/C22H24N4O2/c1-15-14-16(8-9-19(15)26-12-4-5-13-26)23-21(27)11-10-20-24-18-7-3-2-6-17(18)22(28)25-20/h2-3,6-9,14H,4-5,10-13H2,1H3,(H,23,27)(H,24,25,28)