2-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanol

Systemtic Name: 2-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanol Openeye Name: 2-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanol CAS Name: 2-[[5,6-dimethyl-2-[(phenylthio)methyl]-4-thieno[2,3-d]pyrimidinyl]thio]ethanol IUPAC Name: 2-[5,6-dimethyl-2-(phenylsulfanylmethyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylethanol Traditional Name: 2-[[5,6-dimethyl-2-[(phenylthio)methyl]thieno[2,3-d]pyrimidin-4-yl]thio]ethanol Formula: C17H18N2OS3 MolecularWeight: 362.53262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C(=NC(=N2)CSC3=CC=CC=C3)SCCO)C

Isomeric SMILES

CC1=C(SC2=C1C(=NC(=N2)CSC3=CC=CC=C3)SCCO)C

InChI

InChI=1S/C17H18N2OS3/c1-11-12(2)23-17-15(11)16(21-9-8-20)18-14(19-17)10-22-13-6-4-3-5-7-13/h3-7,20H,8-10H2,1-2H3