2-methyl-6-[[(3-methylphenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one

Systemtic Name: 2-methyl-6-[[(3-methylphenyl)-prop-2-ynyl-amino]methyl]-1H-quinazolin-4-one Openeye Name: 2-methyl-6-[(3-methyl-N-prop-2-ynyl-anilino)methyl]-1H-quinazolin-4-one CAS Name: 2-methyl-6-[(3-methyl-N-prop-2-ynylanilino)methyl]-1H-quinazolin-4-one IUPAC Name: 2-methyl-6-[(3-methyl-N-prop-2-ynylanilino)methyl]-1H-quinazolin-4-one Traditional Name: 2-methyl-6-[(3-methyl-N-propargyl-anilino)methyl]-1H-quinazolin-4-one Formula: C20H19N3O MolecularWeight: 317.38436

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N(CC#C)CC2=CC3=C(C=C2)NC(=NC3=O)C

Isomeric SMILES

CC1=CC(=CC=C1)N(CC#C)CC2=CC3=C(C=C2)NC(=NC3=O)C

InChI

InChI=1S/C20H19N3O/c1-4-10-23(17-7-5-6-14(2)11-17)13-16-8-9-19-18(12-16)20(24)22-15(3)21-19/h1,5-9,11-12H,10,13H2,2-3H3,(H,21,22,24)