3-phenyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-sulfanylidene-1H-imidazole-4-carboxamide

Systemtic Name: 3-phenyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-sulfanylidene-1H-imidazole-4-carboxamide Openeye Name: 3-phenyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-thioxo-1H-imidazole-4-carboxamide CAS Name: 3-phenyl-N-(5-spiro[1,3-benzodioxole-2,1'-cyclohexane]yl)-2-sulfanylidene-1H-imidazole-4-carboxamide IUPAC Name: 3-phenyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-sulfanylidene-1H-imidazole-4-carboxamide Traditional Name: 3-phenyl-N-spiro[1,3-benzodioxole-2,1'-cyclohexane]-5-yl-2-thioxo-4-imidazoline-4-carboxamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CNC(=S)N4C5=CC=CC=C5

Isomeric SMILES

C1CCC2(CC1)OC3=C(O2)C=C(C=C3)NC(=O)C4=CNC(=S)N4C5=CC=CC=C5

InChI

InChI=1S/C22H21N3O3S/c26-20(17-14-23-21(29)25(17)16-7-3-1-4-8-16)24-15-9-10-18-19(13-15)28-22(27-18)11-5-2-6-12-22/h1,3-4,7-10,13-14H,2,5-6,11-12H2,(H,23,29)(H,24,26)