4-[[4-(1H-indazol-5-ylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzenecarbonitrile

Systemtic Name: 4-[[4-(1H-indazol-5-ylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzenecarbonitrile Openeye Name: 4-[[4-(1H-indazol-5-ylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzonitrile CAS Name: 4-[[4-(1H-indazol-5-ylamino)-2-thieno[3,2-d]pyrimidinyl]amino]benzonitrile IUPAC Name: 4-[[4-(1H-indazol-5-ylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzonitrile Traditional Name: 4-[[4-(1H-indazol-5-ylamino)thieno[3,2-d]pyrimidin-2-yl]amino]benzonitrile Formula: C20H13N7S MolecularWeight: 383.42912

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C#N)NC2=NC3=C(C(=N2)NC4=CC5=C(C=C4)NN=C5)SC=C3

Isomeric SMILES

C1=CC(=CC=C1C#N)NC2=NC3=C(C(=N2)NC4=CC5=C(C=C4)NN=C5)SC=C3

InChI

InChI=1S/C20H13N7S/c21-10-12-1-3-14(4-2-12)24-20-25-17-7-8-28-18(17)19(26-20)23-15-5-6-16-13(9-15)11-22-27-16/h1-9,11H,(H,22,27)(H2,23,24,25,26)