2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Openeye Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one CAS Name: 2-[[(6-phenyl-4-thieno[2,3-d]pyrimidinyl)thio]methyl]-1H-quinazolin-4-one IUPAC Name: 2-[(6-phenylthieno[2,3-d]pyrimidin-4-yl)sulfanylmethyl]-1H-quinazolin-4-one Traditional Name: 2-[[(6-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=CC3=C(S2)N=CN=C3SCC4=NC(=O)C5=CC=CC=C5N4

Isomeric SMILES

C1=CC=C(C=C1)C2=CC3=C(S2)N=CN=C3SCC4=NC(=O)C5=CC=CC=C5N4

InChI

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