[2-[[4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]phenyl]carbonylamino]-1-phenyl-ethyl] ethanoate

Systemtic Name: [2-[[4-[(2-methyl-4-oxidanylidene-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]phenyl]carbonylamino]-1-phenyl-ethyl] ethanoate Openeye Name: [2-[[4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynyl-amino]benzoyl]amino]-1-phenyl-ethyl] acetate CAS Name: acetic acid [2-[[[4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]phenyl]-oxomethyl]amino]-1-phenylethyl] ester IUPAC Name: [2-[[4-[(2-methyl-4-oxo-1H-quinazolin-6-yl)methyl-prop-2-ynylamino]benzoyl]amino]-1-phenylethyl] acetate Traditional Name: acetic acid [2-[[4-[(4-keto-2-methyl-1H-quinazolin-6-yl)methyl-propargyl-amino]benzoyl]amino]-1-phenyl-ethyl] ester Formula: C30H28N4O4 MolecularWeight: 508.56772

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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)OC(=O)C

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)OC(=O)C

InChI

InChI=1S/C30H28N4O4/c1-4-16-34(19-22-10-15-27-26(17-22)30(37)33-20(2)32-27)25-13-11-24(12-14-25)29(36)31-18-28(38-21(3)35)23-8-6-5-7-9-23/h1,5-15,17,28H,16,18-19H2,2-3H3,(H,31,36)(H,32,33,37)