2-[2-(2-methoxy-6-propan-2-yl-pyridin-3-yl)-3,7-dimethyl-pyrrolo[2,3-b]pyrazin-5-yl]butyl methanesulfonate

Systemtic Name: 2-[2-(2-methoxy-6-propan-2-yl-pyridin-3-yl)-3,7-dimethyl-pyrrolo[2,3-b]pyrazin-5-yl]butyl methanesulfonate Openeye Name: 2-[2-(6-isopropyl-2-methoxy-3-pyridyl)-3,7-dimethyl-pyrrolo[2,3-b]pyrazin-5-yl]butyl methanesulfonate CAS Name: methanesulfonic acid 2-[2-(2-methoxy-6-propan-2-yl-3-pyridinyl)-3,7-dimethyl-5-pyrrolo[2,3-b]pyrazinyl]butyl ester IUPAC Name: 2-[2-(2-methoxy-6-propan-2-ylpyridin-3-yl)-3,7-dimethylpyrrolo[2,3-b]pyrazin-5-yl]butyl methanesulfonate Traditional Name: methanesulfonic acid 2-[2-(6-isopropyl-2-methoxy-3-pyridyl)-3,7-dimethyl-pyrrolo[2,3-b]pyrazin-5-yl]butyl ester Formula: C22H30N4O4S MolecularWeight: 446.563

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COS(=O)(=O)C)N1C=C(C2=C1N=C(C(=N2)C3=C(N=C(C=C3)C(C)C)OC)C)C

Isomeric SMILES

CCC(COS(=O)(=O)C)N1C=C(C2=C1N=C(C(=N2)C3=C(N=C(C=C3)C(C)C)OC)C)C

InChI

InChI=1S/C22H30N4O4S/c1-8-16(12-30-31(7,27)28)26-11-14(4)19-21(26)23-15(5)20(25-19)17-9-10-18(13(2)3)24-22(17)29-6/h9-11,13,16H,8,12H2,1-7H3