5-(4-bromophenyl)-4-hexylsulfanyl-thieno[2,3-d]pyrimidine

Systemtic Name: 5-(4-bromophenyl)-4-hexylsulfanyl-thieno[2,3-d]pyrimidine Openeye Name: 5-(4-bromophenyl)-4-hexylsulfanyl-thieno[2,3-d]pyrimidine CAS Name: 5-(4-bromophenyl)-4-(hexylthio)thieno[2,3-d]pyrimidine IUPAC Name: 5-(4-bromophenyl)-4-hexylsulfanylthieno[2,3-d]pyrimidine Traditional Name: 5-(4-bromophenyl)-4-(hexylthio)thieno[2,3-d]pyrimidine Formula: C18H19BrN2S2 MolecularWeight: 407.39086

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)Br

Isomeric SMILES

CCCCCCSC1=NC=NC2=C1C(=CS2)C3=CC=C(C=C3)Br

InChI

InChI=1S/C18H19BrN2S2/c1-2-3-4-5-10-22-17-16-15(11-23-18(16)21-12-20-17)13-6-8-14(19)9-7-13/h6-9,11-12H,2-5,10H2,1H3