ethyl 2-[[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate

Systemtic Name: ethyl 2-[[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbonylamino]-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[[4-[(2-ethyl-1-piperidyl)sulfonyl]benzoyl]amino]-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[[4-(2-ethylpiperidin-1-yl)sulfonylbenzoyl]amino]-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[[4-(2-ethylpiperidino)sulfonylbenzoyl]amino]-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C24H27N3O5S2 MolecularWeight: 501.61828

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OCC

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)NC3=NC4=C(S3)C=C(C=C4)C(=O)OCC

InChI

InChI=1S/C24H27N3O5S2/c1-3-18-7-5-6-14-27(18)34(30,31)19-11-8-16(9-12-19)22(28)26-24-25-20-13-10-17(15-21(20)33-24)23(29)32-4-2/h8-13,15,18H,3-7,14H2,1-2H3,(H,25,26,28)