3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one

Systemtic Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one Openeye Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanyl-quinazolin-4-one CAS Name: 3-(4-methoxyphenyl)-2-(prop-2-ynylthio)-4-quinazolinone IUPAC Name: 3-(4-methoxyphenyl)-2-prop-2-ynylsulfanylquinazolin-4-one Traditional Name: 3-(4-methoxyphenyl)-2-(propargylthio)quinazolin-4-one Formula: C18H14N2O2S MolecularWeight: 322.38096

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#C

Isomeric SMILES

COC1=CC=C(C=C1)N2C(=O)C3=CC=CC=C3N=C2SCC#C

InChI

InChI=1S/C18H14N2O2S/c1-3-12-23-18-19-16-7-5-4-6-15(16)17(21)20(18)13-8-10-14(22-2)11-9-13/h1,4-11H,12H2,2H3