N-[5-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide

Systemtic Name: N-[5-[2-(3,4-dimethoxyphenyl)ethanoylamino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Openeye Name: N-[5-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide CAS Name: N-[5-[[2-(3,4-dimethoxyphenyl)-1-oxoethyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide IUPAC Name: N-[5-[[2-(3,4-dimethoxyphenyl)acetyl]amino]-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Traditional Name: N-[5-(homoveratroylamino)-1,3-benzothiazol-2-yl]cyclohexanecarboxamide Formula: C24H27N3O4S MolecularWeight: 453.55388

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CC(=O)NC2=CC3=C(C=C2)SC(=N3)NC(=O)C4CCCCC4)OC

InChI

InChI=1S/C24H27N3O4S/c1-30-19-10-8-15(12-20(19)31-2)13-22(28)25-17-9-11-21-18(14-17)26-24(32-21)27-23(29)16-6-4-3-5-7-16/h8-12,14,16H,3-7,13H2,1-2H3,(H,25,28)(H,26,27,29)