N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-(cyclohexylcarbonylamino)-1,3-benzothiazol-5-yl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[[cyclohexyl(oxo)methyl]amino]-1,3-benzothiazol-5-yl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-(cyclohexanecarbonylamino)-1,3-benzothiazol-5-yl]-piperonylamide Formula: C22H21N3O4S MolecularWeight: 423.48484

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=NC3=C(S2)C=CC(=C3)NC(=O)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C22H21N3O4S/c26-20(13-4-2-1-3-5-13)25-22-24-16-11-15(7-9-19(16)30-22)23-21(27)14-6-8-17-18(10-14)29-12-28-17/h6-11,13H,1-5,12H2,(H,23,27)(H,24,25,26)