2-[(4-tert-butylphenyl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one

Systemtic Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Openeye Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one CAS Name: 2-[[(4-tert-butylphenyl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one IUPAC Name: 2-[(4-tert-butylphenyl)sulfanylmethyl]-1H-thieno[3,2-d]pyrimidin-4-one Traditional Name: 2-[[(4-tert-butylphenyl)thio]methyl]-1H-thieno[3,2-d]pyrimidin-4-one Formula: C17H18N2OS2 MolecularWeight: 330.46762

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)SCC2=NC(=O)C3=C(N2)C=CS3

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)SCC2=NC(=O)C3=C(N2)C=CS3

InChI

InChI=1S/C17H18N2OS2/c1-17(2,3)11-4-6-12(7-5-11)22-10-14-18-13-8-9-21-15(13)16(20)19-14/h4-9H,10H2,1-3H3,(H,18,19,20)