2-[4-[2-[(3S,4R)-3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonylthieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-(4,6-dimethylpyridin-2-yl)ethanamide

Systemtic Name: 2-[4-[2-[(3S,4R)-3,4-bis(oxidanyl)pyrrolidin-1-yl]carbonylthieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-(4,6-dimethylpyridin-2-yl)ethanamide Openeye Name: 2-[4-[2-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-(4,6-dimethyl-2-pyridyl)acetamide CAS Name: 2-[4-[[2-[[(3S,4R)-3,4-dihydroxy-1-pyrrolidinyl]-oxomethyl]-7-thieno[3,2-b]pyridinyl]oxy]phenyl]-N-(4,6-dimethyl-2-pyridinyl)acetamide IUPAC Name: 2-[4-[2-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-(4,6-dimethylpyridin-2-yl)acetamide Traditional Name: 2-[4-[2-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]thieno[3,2-b]pyridin-7-yl]oxyphenyl]-N-(4,6-dimethyl-2-pyridyl)acetamide Formula: C27H26N4O5S MolecularWeight: 518.58414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NC(=C1)NC(=O)CC2=CC=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5CC(C(C5)O)O)C

Isomeric SMILES

CC1=CC(=NC(=C1)NC(=O)CC2=CC=C(C=C2)OC3=C4C(=NC=C3)C=C(S4)C(=O)N5C[C@H]([C@H](C5)O)O)C

InChI

InChI=1S/C27H26N4O5S/c1-15-9-16(2)29-24(10-15)30-25(34)11-17-3-5-18(6-4-17)36-22-7-8-28-19-12-23(37-26(19)22)27(35)31-13-20(32)21(33)14-31/h3-10,12,20-21,32-33H,11,13-14H2,1-2H3,(H,29,30,34)/t20-,21+