5-(4-bromophenyl)-6-ethyl-N-(3-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: 5-(4-bromophenyl)-6-ethyl-N-(3-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-amine Openeye Name: 5-(4-bromophenyl)-6-ethyl-N-(3-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-amine CAS Name: 5-(4-bromophenyl)-6-ethyl-N-[3-(methylthio)phenyl]-4-thieno[2,3-d]pyrimidinamine IUPAC Name: 5-(4-bromophenyl)-6-ethyl-N-(3-methylsulfanylphenyl)thieno[2,3-d]pyrimidin-4-amine Traditional Name: [5-(4-bromophenyl)-6-ethyl-thieno[2,3-d]pyrimidin-4-yl]-[3-(methylthio)phenyl]amine Formula: C21H18BrN3S2 MolecularWeight: 456.42172

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(N=CN=C2S1)NC3=CC(=CC=C3)SC)C4=CC=C(C=C4)Br

Isomeric SMILES

CCC1=C(C2=C(N=CN=C2S1)NC3=CC(=CC=C3)SC)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H18BrN3S2/c1-3-17-18(13-7-9-14(22)10-8-13)19-20(23-12-24-21(19)27-17)25-15-5-4-6-16(11-15)26-2/h4-12H,3H2,1-2H3,(H,23,24,25)