N-[[(4-ethanoylphenyl)-prop-2-ynyl-amino]methyl]-2,2-dimethyl-N-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide

Systemtic Name: N-[[(4-ethanoylphenyl)-prop-2-ynyl-amino]methyl]-2,2-dimethyl-N-(4-oxidanylidene-1H-quinazolin-2-yl)propanamide Openeye Name: N-[(4-acetyl-N-prop-2-ynyl-anilino)methyl]-2,2-dimethyl-N-(4-oxo-1H-quinazolin-2-yl)propanamide CAS Name: N-[(4-acetyl-N-prop-2-ynylanilino)methyl]-2,2-dimethyl-N-(4-oxo-1H-quinazolin-2-yl)propanamide IUPAC Name: N-[(4-acetyl-N-prop-2-ynylanilino)methyl]-2,2-dimethyl-N-(4-oxo-1H-quinazolin-2-yl)propanamide Traditional Name: N-[(4-acetyl-N-propargyl-anilino)methyl]-N-(4-keto-1H-quinazolin-2-yl)-2,2-dimethyl-propionamide Formula: C25H26N4O3 MolecularWeight: 430.49894

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)N(CC#C)CN(C2=NC(=O)C3=CC=CC=C3N2)C(=O)C(C)(C)C

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)N(CC#C)CN(C2=NC(=O)C3=CC=CC=C3N2)C(=O)C(C)(C)C

InChI

InChI=1S/C25H26N4O3/c1-6-15-28(19-13-11-18(12-14-19)17(2)30)16-29(23(32)25(3,4)5)24-26-21-10-8-7-9-20(21)22(31)27-24/h1,7-14H,15-16H2,2-5H3,(H,26,27,31)