3-phenethyl-2-(phenylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 3-phenethyl-2-(phenylmethylsulfanyl)thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-benzylsulfanyl-3-phenethyl-thieno[3,2-d]pyrimidin-4-one CAS Name: 3-phenethyl-2-(phenylmethylthio)-4-thieno[3,2-d]pyrimidinone IUPAC Name: 2-benzylsulfanyl-3-phenethylthieno[3,2-d]pyrimidin-4-one Traditional Name: 2-(benzylthio)-3-phenethyl-thieno[3,2-d]pyrimidin-4-one Formula: C21H18N2OS2 MolecularWeight: 378.51042

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CS3)N=C2SCC4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)CCN2C(=O)C3=C(C=CS3)N=C2SCC4=CC=CC=C4

InChI

InChI=1S/C21H18N2OS2/c24-20-19-18(12-14-25-19)22-21(26-15-17-9-5-2-6-10-17)23(20)13-11-16-7-3-1-4-8-16/h1-10,12,14H,11,13,15H2