tert-butyl 3-[2-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-1,3-thiazol-4-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 3-[2-[(5-chloranyl-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-1,3-thiazol-4-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 3-[2-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]thiazol-4-yl]piperidine-1-carboxylate CAS Name: 3-[2-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-4-thiazolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-[2-[(5-chloro-3-methyl-1-benzothiophen-2-yl)sulfonylamino]-1,3-thiazol-4-yl]piperidine-1-carboxylate Traditional Name: 3-[2-[(5-chloro-3-methyl-benzothiophen-2-yl)sulfonylamino]thiazol-4-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C22H26ClN3O4S3 MolecularWeight: 528.10754

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=NC(=CS3)C4CCCN(C4)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(SC2=C1C=C(C=C2)Cl)S(=O)(=O)NC3=NC(=CS3)C4CCCN(C4)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H26ClN3O4S3/c1-13-16-10-15(23)7-8-18(16)32-19(13)33(28,29)25-20-24-17(12-31-20)14-6-5-9-26(11-14)21(27)30-22(2,3)4/h7-8,10,12,14H,5-6,9,11H2,1-4H3,(H,24,25)