ethyl 2-[2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylimino-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate

Systemtic Name: ethyl 2-[2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]carbonylimino-6-ethoxy-1,3-benzothiazol-3-yl]ethanoate Openeye Name: ethyl 2-[2-[4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate CAS Name: 2-[2-[[4-[(3,5-dimethyl-1-piperidinyl)sulfonyl]phenyl]-oxomethyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester IUPAC Name: ethyl 2-[2-[4-(3,5-dimethylpiperidin-1-yl)sulfonylbenzoyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetate Traditional Name: 2-[2-[4-(3,5-dimethylpiperidino)sulfonylbenzoyl]imino-6-ethoxy-1,3-benzothiazol-3-yl]acetic acid ethyl ester Formula: C27H33N3O6S2 MolecularWeight: 559.69742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C)S2)CC(=O)OCC

Isomeric SMILES

CCOC1=CC2=C(C=C1)N(C(=NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CC(CC(C4)C)C)S2)CC(=O)OCC

InChI

InChI=1S/C27H33N3O6S2/c1-5-35-21-9-12-23-24(14-21)37-27(30(23)17-25(31)36-6-2)28-26(32)20-7-10-22(11-8-20)38(33,34)29-15-18(3)13-19(4)16-29/h7-12,14,18-19H,5-6,13,15-17H2,1-4H3