(2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate

Systemtic Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Openeye Name: (2-thioxo-1,3-benzothiazol-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate CAS Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl ester IUPAC Name: (2-sulfanylidene-1,3-benzothiazol-3-yl)methyl 1,2,3,4-tetrahydroacridine-9-carboxylate Traditional Name: 1,2,3,4-tetrahydroacridine-9-carboxylic acid (2-thioxo-1,3-benzothiazol-3-yl)methyl ester Formula: C22H18N2O2S2 MolecularWeight: 406.52052

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCN4C5=CC=CC=C5SC4=S

Isomeric SMILES

C1CCC2=NC3=CC=CC=C3C(=C2C1)C(=O)OCN4C5=CC=CC=C5SC4=S

InChI

InChI=1S/C22H18N2O2S2/c25-21(26-13-24-18-11-5-6-12-19(18)28-22(24)27)20-14-7-1-3-9-16(14)23-17-10-4-2-8-15(17)20/h1,3,5-7,9,11-12H,2,4,8,10,13H2