2-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile

Systemtic Name: 2-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-4-oxidanylidene-quinazolin-3-yl]ethanenitrile Openeye Name: 2-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-4-oxo-quinazolin-3-yl]acetonitrile CAS Name: 2-[2-[[(5,6-dimethyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-4-oxo-3-quinazolinyl]acetonitrile IUPAC Name: 2-[2-[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-4-oxoquinazolin-3-yl]acetonitrile Traditional Name: 2-[2-[[(5,6-dimethylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]-4-keto-quinazolin-3-yl]acetonitrile Formula: C19H15N5OS2 MolecularWeight: 393.4853

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC=N2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC=N2)SCC3=NC4=CC=CC=C4C(=O)N3CC#N)C

InChI

InChI=1S/C19H15N5OS2/c1-11-12(2)27-18-16(11)17(21-10-22-18)26-9-15-23-14-6-4-3-5-13(14)19(25)24(15)8-7-20/h3-6,10H,8-9H2,1-2H3