ethyl 2-[2-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylimino-6-methyl-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[1-(4-chlorophenyl)sulfonylpiperidin-4-yl]carbonylimino-6-methyl-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[[1-(4-chlorophenyl)sulfonyl-4-piperidinyl]-oxomethyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[1-(4-chlorophenyl)sulfonylpiperidine-4-carbonyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[1-(4-chlorophenyl)sulfonylisonipecotoyl]imino-6-methyl-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C24H26ClN3O5S2 MolecularWeight: 536.06334

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

CCOC(=O)CN1C2=C(C=C(C=C2)C)SC1=NC(=O)C3CCN(CC3)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C24H26ClN3O5S2/c1-3-33-22(29)15-28-20-9-4-16(2)14-21(20)34-24(28)26-23(30)17-10-12-27(13-11-17)35(31,32)19-7-5-18(25)6-8-19/h4-9,14,17H,3,10-13,15H2,1-2H3