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

Systemtic Name: ethyl 2-[4-(2-ethylpiperidin-1-yl)sulfonylphenyl]carbonylimino-3-methyl-1,3-benzothiazole-6-carboxylate Openeye Name: ethyl 2-[4-[(2-ethyl-1-piperidyl)sulfonyl]benzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate CAS Name: 2-[[4-[(2-ethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(2-ethylpiperidin-1-yl)sulfonylbenzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylate Traditional Name: 2-[4-(2-ethylpiperidino)sulfonylbenzoyl]imino-3-methyl-1,3-benzothiazole-6-carboxylic acid ethyl ester Formula: C25H29N3O5S2 MolecularWeight: 515.64486

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)C(=O)OCC)C

Isomeric SMILES

CCC1CCCCN1S(=O)(=O)C2=CC=C(C=C2)C(=O)N=C3N(C4=C(S3)C=C(C=C4)C(=O)OCC)C

InChI

InChI=1S/C25H29N3O5S2/c1-4-19-8-6-7-15-28(19)35(31,32)20-12-9-17(10-13-20)23(29)26-25-27(3)21-14-11-18(16-22(21)34-25)24(30)33-5-2/h9-14,16,19H,4-8,15H2,1-3H3