4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-(2-oxidanyl-1-phenyl-ethyl)benzamide

Systemtic Name: 4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]-N-(2-oxidanyl-1-phenyl-ethyl)benzamide Openeye Name: N-(2-hydroxy-1-phenyl-ethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide CAS Name: N-(2-hydroxy-1-phenylethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide IUPAC Name: N-(2-hydroxy-1-phenylethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide Traditional Name: N-(2-hydroxy-1-phenyl-ethyl)-4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]benzamide Formula: C28H26N4O3 MolecularWeight: 466.53104

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)C3=CC=C(C=C3)C(=O)NC(CO)C4=CC=CC=C4

Isomeric SMILES

CC1=NC(=O)C2=C(N1)C=CC(=C2)CN(CC#C)C3=CC=C(C=C3)C(=O)NC(CO)C4=CC=CC=C4

InChI

InChI=1S/C28H26N4O3/c1-3-15-32(17-20-9-14-25-24(16-20)28(35)30-19(2)29-25)23-12-10-22(11-13-23)27(34)31-26(18-33)21-7-5-4-6-8-21/h1,4-14,16,26,33H,15,17-18H2,2H3,(H,31,34)(H,29,30,35)