O-(5-methoxy-6'-oxidanylidene-spiro[2,4-dihydrochromene-3,2'-piperidine]-3'-yl) imidazole-1-carbothioate

Systemtic Name: O-(5-methoxy-6'-oxidanylidene-spiro[2,4-dihydrochromene-3,2'-piperidine]-3'-yl) imidazole-1-carbothioate Openeye Name: O-(5-methoxy-6'-oxo-spiro[chromane-3,2'-piperidine]-3'-yl) imidazole-1-carbothioate CAS Name: 1-imidazolecarbothioic acid O-(5-methoxy-6'-oxo-3'-spiro[3,4-dihydro-2H-1-benzopyran-3,2'-piperidine]yl) ester IUPAC Name: O-(5-methoxy-6'-oxospiro[2,4-dihydrochromene-3,2'-piperidine]-3'-yl) imidazole-1-carbothioate Traditional Name: imidazole-1-carbothioic acid O-(6'-keto-5-methoxy-spiro[chroman-3,2'-piperidine]-3'-yl) ester Formula: C18H19N3O4S MolecularWeight: 373.42616

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC2=C1CC3(CO2)C(CCC(=O)N3)OC(=S)N4C=CN=C4

Isomeric SMILES

COC1=CC=CC2=C1CC3(CO2)C(CCC(=O)N3)OC(=S)N4C=CN=C4

InChI

InChI=1S/C18H19N3O4S/c1-23-13-3-2-4-14-12(13)9-18(10-24-14)15(5-6-16(22)20-18)25-17(26)21-8-7-19-11-21/h2-4,7-8,11,15H,5-6,9-10H2,1H3,(H,20,22)