6-(3-azanylprop-1-ynyl)-N-[1-(phenylmethyl)indazol-5-yl]thieno[3,2-d]pyrimidin-4-amine

Systemtic Name: 6-(3-azanylprop-1-ynyl)-N-[1-(phenylmethyl)indazol-5-yl]thieno[3,2-d]pyrimidin-4-amine Openeye Name: 6-(3-aminoprop-1-ynyl)-N-(1-benzylindazol-5-yl)thieno[3,2-d]pyrimidin-4-amine CAS Name: 6-(3-aminoprop-1-ynyl)-N-[1-(phenylmethyl)-5-indazolyl]-4-thieno[3,2-d]pyrimidinamine IUPAC Name: 6-(3-aminoprop-1-ynyl)-N-(1-benzylindazol-5-yl)thieno[3,2-d]pyrimidin-4-amine Traditional Name: [6-(3-aminoprop-1-ynyl)thieno[3,2-d]pyrimidin-4-yl]-(1-benzylindazol-5-yl)amine Formula: C23H18N6S MolecularWeight: 410.49422

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC5=C4SC(=C5)C#CCN)C=N2

Isomeric SMILES

C1=CC=C(C=C1)CN2C3=C(C=C(C=C3)NC4=NC=NC5=C4SC(=C5)C#CCN)C=N2

InChI

InChI=1S/C23H18N6S/c24-10-4-7-19-12-20-22(30-19)23(26-15-25-20)28-18-8-9-21-17(11-18)13-27-29(21)14-16-5-2-1-3-6-16/h1-3,5-6,8-9,11-13,15H,10,14,24H2,(H,25,26,28)