(1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxamide

Systemtic Name: (1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxamide Openeye Name: (1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxamide CAS Name: (1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)-3'-spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]carboxamide IUPAC Name: (1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxamide Traditional Name: (1'R,5'S)-N-(6-ethyl-1,3-benzothiazol-2-yl)spiro[1,3-dithiolane-2,8'-bicyclo[3.2.1]octane]-3'-carboxamide Formula: C20H24N2OS3 MolecularWeight: 404.61236

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3CC4CCC(C3)C45SCCS5

Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)C3C[C@H]4CC[C@@H](C3)C45SCCS5

InChI

InChI=1S/C20H24N2OS3/c1-2-12-3-6-16-17(9-12)26-19(21-16)22-18(23)13-10-14-4-5-15(11-13)20(14)24-7-8-25-20/h3,6,9,13-15H,2,4-5,7-8,10-11H2,1H3,(H,21,22,23)/t13?,14-,15+