4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine

Systemtic Name: 4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Openeye Name: 4-phenethylsulfanyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine CAS Name: 4-(phenethylthio)-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine IUPAC Name: 4-phenethylsulfanyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidine Traditional Name: 4-(phenethylthio)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine Formula: C18H18N2S2 MolecularWeight: 326.47892

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=C(C1)C3=C(S2)N=CN=C3SCCC4=CC=CC=C4

Isomeric SMILES

C1CCC2=C(C1)C3=C(S2)N=CN=C3SCCC4=CC=CC=C4

InChI

InChI=1S/C18H18N2S2/c1-2-6-13(7-3-1)10-11-21-17-16-14-8-4-5-9-15(14)22-18(16)20-12-19-17/h1-3,6-7,12H,4-5,8-11H2