O-tert-butyl 3-azanyl-4,6-dimethyl-5-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate

Systemtic Name: O-tert-butyl 3-azanyl-4,6-dimethyl-5-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate Openeye Name: O-tert-butyl 3-amino-4,6-dimethyl-5-(2-morpholinoethoxy)thieno[2,3-b]pyridine-2-carbothioate CAS Name: 3-amino-4,6-dimethyl-5-[2-(4-morpholinyl)ethoxy]-2-thieno[2,3-b]pyridinecarbothioic acid O-tert-butyl ester IUPAC Name: O-tert-butyl 3-amino-4,6-dimethyl-5-(2-morpholin-4-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate Traditional Name: 3-amino-4,6-dimethyl-5-(2-morpholinoethoxy)thieno[2,3-b]pyridine-2-carbothioic acid O-tert-butyl ester Formula: C20H29N3O3S2 MolecularWeight: 423.59256

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(SC2=NC(=C1OCCN3CCOCC3)C)C(=S)OC(C)(C)C)N

Isomeric SMILES

CC1=C2C(=C(SC2=NC(=C1OCCN3CCOCC3)C)C(=S)OC(C)(C)C)N

InChI

InChI=1S/C20H29N3O3S2/c1-12-14-15(21)17(19(27)26-20(3,4)5)28-18(14)22-13(2)16(12)25-11-8-23-6-9-24-10-7-23/h6-11,21H2,1-5H3