O-tert-butyl 3-azanyl-4,6-dimethyl-5-(2-piperidin-1-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate

Systemtic Name: O-tert-butyl 3-azanyl-4,6-dimethyl-5-(2-piperidin-1-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate Openeye Name: O-tert-butyl 3-amino-4,6-dimethyl-5-[2-(1-piperidyl)ethoxy]thieno[2,3-b]pyridine-2-carbothioate CAS Name: 3-amino-4,6-dimethyl-5-[2-(1-piperidinyl)ethoxy]-2-thieno[2,3-b]pyridinecarbothioic acid O-tert-butyl ester IUPAC Name: O-tert-butyl 3-amino-4,6-dimethyl-5-(2-piperidin-1-ylethoxy)thieno[2,3-b]pyridine-2-carbothioate Traditional Name: 3-amino-4,6-dimethyl-5-(2-piperidinoethoxy)thieno[2,3-b]pyridine-2-carbothioic acid O-tert-butyl ester Formula: C21H31N3O2S2 MolecularWeight: 421.61974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=C(SC2=NC(=C1OCCN3CCCCC3)C)C(=S)OC(C)(C)C)N

Isomeric SMILES

CC1=C2C(=C(SC2=NC(=C1OCCN3CCCCC3)C)C(=S)OC(C)(C)C)N

InChI

InChI=1S/C21H31N3O2S2/c1-13-15-16(22)18(20(27)26-21(3,4)5)28-19(15)23-14(2)17(13)25-12-11-24-9-7-6-8-10-24/h6-12,22H2,1-5H3