tert-butyl 4-[2-[3-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]thiophen-2-yl]ethanoyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[3-[(3-chloranyl-2-methyl-phenyl)sulfonylamino]thiophen-2-yl]ethanoyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[3-[(3-chloro-2-methyl-phenyl)sulfonylamino]-2-thienyl]acetyl]piperazine-1-carboxylate CAS Name: 4-[2-[3-[(3-chloro-2-methylphenyl)sulfonylamino]-2-thiophenyl]-1-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[3-[(3-chloro-2-methylphenyl)sulfonylamino]thiophen-2-yl]acetyl]piperazine-1-carboxylate Traditional Name: 4-[2-[3-[(3-chloro-2-methyl-phenyl)sulfonylamino]-2-thienyl]acetyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C22H28ClN3O5S2 MolecularWeight: 514.05782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=C(SC=C2)CC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

Isomeric SMILES

CC1=C(C=CC=C1Cl)S(=O)(=O)NC2=C(SC=C2)CC(=O)N3CCN(CC3)C(=O)OC(C)(C)C

InChI

InChI=1S/C22H28ClN3O5S2/c1-15-16(23)6-5-7-19(15)33(29,30)24-17-8-13-32-18(17)14-20(27)25-9-11-26(12-10-25)21(28)31-22(2,3)4/h5-8,13,24H,9-12,14H2,1-4H3