2-hexylsulfanyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one

Systemtic Name: 2-hexylsulfanyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Openeye Name: 2-hexylsulfanyl-5-tetralin-6-yl-3H-thieno[2,3-d]pyrimidin-4-one CAS Name: 2-(hexylthio)-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one IUPAC Name: 2-hexylsulfanyl-5-(5,6,7,8-tetrahydronaphthalen-2-yl)-3H-thieno[2,3-d]pyrimidin-4-one Traditional Name: 2-(hexylthio)-5-tetralin-6-yl-3H-thieno[2,3-d]pyrimidin-4-one Formula: C22H26N2OS2 MolecularWeight: 398.58464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC2=C(C(=CS2)C3=CC4=C(CCCC4)C=C3)C(=O)N1

Isomeric SMILES

CCCCCCSC1=NC2=C(C(=CS2)C3=CC4=C(CCCC4)C=C3)C(=O)N1

InChI

InChI=1S/C22H26N2OS2/c1-2-3-4-7-12-26-22-23-20(25)19-18(14-27-21(19)24-22)17-11-10-15-8-5-6-9-16(15)13-17/h10-11,13-14H,2-9,12H2,1H3,(H,23,24,25)