N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-amine

Systemtic Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-amine Openeye Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-amine CAS Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-amine IUPAC Name: N-[4-(1,3-benzothiazol-2-yl)-3-methoxyphenyl]-2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-amine Traditional Name: [4-(1,3-benzothiazol-2-yl)-3-methoxy-phenyl]-(2-methoxy-7H-pyrrolo[2,3-d]pyrimidin-4-yl)amine Formula: C21H17N5O2S MolecularWeight: 403.45698

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC2=NC(=NC3=C2C=CN3)OC)C4=NC5=CC=CC=C5S4

Isomeric SMILES

COC1=C(C=CC(=C1)NC2=NC(=NC3=C2C=CN3)OC)C4=NC5=CC=CC=C5S4

InChI

InChI=1S/C21H17N5O2S/c1-27-16-11-12(23-19-14-9-10-22-18(14)25-21(26-19)28-2)7-8-13(16)20-24-15-5-3-4-6-17(15)29-20/h3-11H,1-2H3,(H2,22,23,25,26)