1-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-4-methyl-quinazolin-2-one

Systemtic Name: 1-[3-(1,2-diazepin-1-yl)prop-2-ynyl]-4-methyl-quinazolin-2-one Openeye Name: 1-[3-(diazepin-1-yl)prop-2-ynyl]-4-methyl-quinazolin-2-one CAS Name: 1-[3-(1-diazepinyl)prop-2-ynyl]-4-methyl-2-quinazolinone IUPAC Name: 1-[3-(diazepin-1-yl)prop-2-ynyl]-4-methylquinazolin-2-one Traditional Name: 1-[3-(diazepin-1-yl)prop-2-ynyl]-4-methyl-quinazolin-2-one Formula: C17H14N4O MolecularWeight: 290.31926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=O)N(C2=CC=CC=C12)CC#CN3C=CC=CC=N3

Isomeric SMILES

CC1=NC(=O)N(C2=CC=CC=C12)CC#CN3C=CC=CC=N3

InChI

InChI=1S/C17H14N4O/c1-14-15-8-3-4-9-16(15)21(17(22)19-14)13-7-12-20-11-6-2-5-10-18-20/h2-6,8-11H,13H2,1H3