N-[1-(4-chlorophenyl)-2-oxidanylidene-propyl]-4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide

Systemtic Name: N-[1-(4-chlorophenyl)-2-oxidanylidene-propyl]-4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide Openeye Name: N-[1-(4-chlorophenyl)-2-oxo-propyl]-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzamide CAS Name: N-[1-(4-chlorophenyl)-2-oxopropyl]-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide IUPAC Name: N-[1-(4-chlorophenyl)-2-oxopropyl]-4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzamide Traditional Name: N-[1-(4-chlorophenyl)-2-keto-propyl]-4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]benzamide Formula: C29H25ClN4O3 MolecularWeight: 512.9868

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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(C4=CC=C(C=C4)Cl)C(=O)C

Isomeric SMILES

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

InChI

InChI=1S/C29H25ClN4O3/c1-4-15-34(17-20-5-14-26-25(16-20)29(37)32-19(3)31-26)24-12-8-22(9-13-24)28(36)33-27(18(2)35)21-6-10-23(30)11-7-21/h1,5-14,16,27H,15,17H2,2-3H3,(H,33,36)(H,31,32,37)