N-(1,3-benzodioxol-5-yl)-5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-5-(4-bromophenyl)-6-methyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-5-(4-bromophenyl)-6-methylthieno[2,3-d]pyrimidin-4-amine Traditional Name: 1,3-benzodioxol-5-yl-[5-(4-bromophenyl)-6-methyl-thieno[2,3-d]pyrimidin-4-yl]amine Formula: C20H14BrN3O2S MolecularWeight: 440.31306

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Br

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)Br

InChI

InChI=1S/C20H14BrN3O2S/c1-11-17(12-2-4-13(21)5-3-12)18-19(22-9-23-20(18)27-11)24-14-6-7-15-16(8-14)26-10-25-15/h2-9H,10H2,1H3,(H,22,23,24)