N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-amine

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-amine Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-amine CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-phenyl-4-thieno[2,3-d]pyrimidinamine IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-yl)-6-methyl-5-phenylthieno[2,3-d]pyrimidin-4-amine Traditional Name: 2,3-dihydro-1,4-benzodioxin-6-yl-(6-methyl-5-phenyl-thieno[2,3-d]pyrimidin-4-yl)amine Formula: C21H17N3O2S MolecularWeight: 375.44358

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(N=CN=C2S1)NC3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C2=C(N=CN=C2S1)NC3=CC4=C(C=C3)OCCO4)C5=CC=CC=C5

InChI

InChI=1S/C21H17N3O2S/c1-13-18(14-5-3-2-4-6-14)19-20(22-12-23-21(19)27-13)24-15-7-8-16-17(11-15)26-10-9-25-16/h2-8,11-12H,9-10H2,1H3,(H,22,23,24)