N-butyl-3-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]but-2-enamide

Systemtic Name: N-butyl-3-methyl-N-[(4-oxidanylidene-1H-quinazolin-2-yl)methyl]but-2-enamide Openeye Name: N-butyl-3-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]but-2-enamide CAS Name: N-butyl-3-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]-2-butenamide IUPAC Name: N-butyl-3-methyl-N-[(4-oxo-1H-quinazolin-2-yl)methyl]but-2-enamide Traditional Name: N-butyl-N-[(4-keto-1H-quinazolin-2-yl)methyl]-3-methyl-but-2-enamide Formula: C18H23N3O2 MolecularWeight: 313.39412

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C=C(C)C

Isomeric SMILES

CCCCN(CC1=NC(=O)C2=CC=CC=C2N1)C(=O)C=C(C)C

InChI

InChI=1S/C18H23N3O2/c1-4-5-10-21(17(22)11-13(2)3)12-16-19-15-9-7-6-8-14(15)18(23)20-16/h6-9,11H,4-5,10,12H2,1-3H3,(H,19,20,23)