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

Systemtic Name: N-(2-azanyl-2-phenyl-ethyl)-4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide Openeye Name: N-(2-amino-2-phenyl-ethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide CAS Name: N-(2-amino-2-phenylethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide IUPAC Name: N-(2-amino-2-phenylethyl)-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide Traditional Name: N-(2-amino-2-phenyl-ethyl)-4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]benzamide Formula: C28H27N5O2 MolecularWeight: 465.54628

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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)NCC(C4=CC=CC=C4)N

Isomeric SMILES

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

InChI

InChI=1S/C28H27N5O2/c1-3-15-33(18-20-9-14-26-24(16-20)28(35)32-19(2)31-26)23-12-10-22(11-13-23)27(34)30-17-25(29)21-7-5-4-6-8-21/h1,4-14,16,25H,15,17-18,29H2,2H3,(H,30,34)(H,31,32,35)