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

Systemtic Name: O-tert-butyl 3-azanyl-5-[2-(4-ethylpiperazin-1-yl)ethoxy]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbothioate Openeye Name: O-tert-butyl 3-amino-5-[2-(4-ethylpiperazin-1-yl)ethoxy]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbothioate CAS Name: 3-amino-5-[2-(4-ethyl-1-piperazinyl)ethoxy]-4,6-dimethyl-2-thieno[2,3-b]pyridinecarbothioic acid O-tert-butyl ester IUPAC Name: O-tert-butyl 3-amino-5-[2-(4-ethylpiperazin-1-yl)ethoxy]-4,6-dimethylthieno[2,3-b]pyridine-2-carbothioate Traditional Name: 3-amino-5-[2-(4-ethylpiperazino)ethoxy]-4,6-dimethyl-thieno[2,3-b]pyridine-2-carbothioic acid O-tert-butyl ester Formula: C22H34N4O2S2 MolecularWeight: 450.66096

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CCOC2=C(N=C3C(=C2C)C(=C(S3)C(=S)OC(C)(C)C)N)C

Isomeric SMILES

CCN1CCN(CC1)CCOC2=C(N=C3C(=C2C)C(=C(S3)C(=S)OC(C)(C)C)N)C

InChI

InChI=1S/C22H34N4O2S2/c1-7-25-8-10-26(11-9-25)12-13-27-18-14(2)16-17(23)19(21(29)28-22(4,5)6)30-20(16)24-15(18)3/h7-13,23H2,1-6H3