6-ethanoyl-5-methyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 6-ethanoyl-5-methyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 6-acetyl-5-methyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 6-acetyl-5-methyl-2-[(4-quinazolinylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 6-acetyl-5-methyl-2-(quinazolin-4-ylsulfanylmethyl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 6-acetyl-5-methyl-2-[(quinazolin-4-ylthio)methyl]-3H-thieno[2,3-d]pyrimidin-4-one Formula: C18H14N4O2S2 MolecularWeight: 382.45936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=NC4=CC=CC=C43)C(=O)C

Isomeric SMILES

CC1=C(SC2=C1C(=O)NC(=N2)CSC3=NC=NC4=CC=CC=C43)C(=O)C

InChI

InChI=1S/C18H14N4O2S2/c1-9-14-16(24)21-13(22-18(14)26-15(9)10(2)23)7-25-17-11-5-3-4-6-12(11)19-8-20-17/h3-6,8H,7H2,1-2H3,(H,21,22,24)