2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(5-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(5-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(5-phenylthieno[2,3-d]pyrimidin-4-yl)thio]methyl]-1H-quinazolin-4-one Formula: C21H14N4OS2 MolecularWeight: 402.49206

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CSC3=C2C(=NC=N3)SCC4=NC(=O)C5=CC=CC=C5N4

InChI

InChI=1S/C21H14N4OS2/c26-19-14-8-4-5-9-16(14)24-17(25-19)11-28-21-18-15(13-6-2-1-3-7-13)10-27-20(18)22-12-23-21/h1-10,12H,11H2,(H,24,25,26)