4-(3-methylbutylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidine

Systemtic Name: 4-(3-methylbutylsulfanyl)-5-phenyl-thieno[2,3-d]pyrimidine Openeye Name: 4-isopentylsulfanyl-5-phenyl-thieno[2,3-d]pyrimidine CAS Name: 4-(3-methylbutylthio)-5-phenylthieno[2,3-d]pyrimidine IUPAC Name: 4-(3-methylbutylsulfanyl)-5-phenylthieno[2,3-d]pyrimidine Traditional Name: 4-(isoamylthio)-5-phenyl-thieno[2,3-d]pyrimidine Formula: C17H18N2S2 MolecularWeight: 314.46822

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCSC1=NC=NC2=C1C(=CS2)C3=CC=CC=C3

Isomeric SMILES

CC(C)CCSC1=NC=NC2=C1C(=CS2)C3=CC=CC=C3

InChI

InChI=1S/C17H18N2S2/c1-12(2)8-9-20-16-15-14(13-6-4-3-5-7-13)10-21-17(15)19-11-18-16/h3-7,10-12H,8-9H2,1-2H3