2-azanyl-6-[[(4-ethanehydrazonoylphenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-azanyl-6-[[(4-ethanehydrazonoylphenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-amino-6-[(4-ethanehydrazonoyl-N-prop-2-ynyl-anilino)methyl]-1H-quinazolin-4-one CAS Name: 2-amino-6-[[4-[(1Z)-1-hydrazinylideneethyl]-N-prop-2-ynylanilino]methyl]-1H-quinazolin-4-one IUPAC Name: 2-amino-6-[(4-ethanehydrazonoyl-N-prop-2-ynylanilino)methyl]-1H-quinazolin-4-one Traditional Name: 6-[(4-acetohydrazonoyl-N-propargyl-anilino)methyl]-2-amino-1H-quinazolin-4-one Formula: C20H20N6O MolecularWeight: 360.4124

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NN)C1=CC=C(C=C1)N(CC#C)CC2=CC3=C(C=C2)NC(=NC3=O)N

Isomeric SMILES

C/C(=N/N)/C1=CC=C(C=C1)N(CC#C)CC2=CC3=C(C=C2)NC(=NC3=O)N

InChI

InChI=1S/C20H20N6O/c1-3-10-26(16-7-5-15(6-8-16)13(2)25-22)12-14-4-9-18-17(11-14)19(27)24-20(21)23-18/h1,4-9,11H,10,12,22H2,2H3,(H3,21,23,24,27)/b25-13-