N-(1H-indazol-6-yl)-5,6-dimethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-1-ium-4-amine

Systemtic Name: N-(1H-indazol-6-yl)-5,6-dimethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-1-ium-4-amine Openeye Name: N-(1H-indazol-6-yl)-5,6-dimethyl-2-(morpholinomethyl)thieno[2,3-d]pyrimidin-1-ium-4-amine CAS Name: N-(1H-indazol-6-yl)-5,6-dimethyl-2-(4-morpholinylmethyl)-4-thieno[2,3-d]pyrimidin-1-iumamine IUPAC Name: N-(1H-indazol-6-yl)-5,6-dimethyl-2-(morpholin-4-ylmethyl)thieno[2,3-d]pyrimidin-1-ium-4-amine Traditional Name: [5,6-dimethyl-2-(morpholinomethyl)thieno[2,3-d]pyrimidin-1-ium-4-yl]-(1H-indazol-6-yl)amine Formula: C20H23N6OS+ MolecularWeight: 395.50122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=[NH+]C(=NC(=C12)NC3=CC4=C(C=C3)C=NN4)CN5CCOCC5)C

Isomeric SMILES

CC1=C(SC2=[NH+]C(=NC(=C12)NC3=CC4=C(C=C3)C=NN4)CN5CCOCC5)C

InChI

InChI=1S/C20H22N6OS/c1-12-13(2)28-20-18(12)19(22-15-4-3-14-10-21-25-16(14)9-15)23-17(24-20)11-26-5-7-27-8-6-26/h3-4,9-10H,5-8,11H2,1-2H3,(H,21,25)(H,22,23,24)/p+1