S-[2-[(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] benzenecarbothioate

Systemtic Name: S-[2-[(5,5-dimethyl-7-oxidanylidene-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-2-oxidanylidene-ethyl] benzenecarbothioate Openeye Name: S-[2-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-2-oxo-ethyl] benzenecarbothioate CAS Name: benzenecarbothioic acid S-[2-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] ester IUPAC Name: S-[2-[(5,5-dimethyl-7-oxo-4,6-dihydro-1,3-benzothiazol-2-yl)amino]-2-oxoethyl] benzenecarbothioate Traditional Name: thiobenzoic acid S-[2-keto-2-[(7-keto-5,5-dimethyl-4,6-dihydro-1,3-benzothiazol-2-yl)amino]ethyl] ester Formula: C18H18N2O3S2 MolecularWeight: 374.47712

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)CSC(=O)C3=CC=CC=C3)C

Isomeric SMILES

CC1(CC2=C(C(=O)C1)SC(=N2)NC(=O)CSC(=O)C3=CC=CC=C3)C

InChI

InChI=1S/C18H18N2O3S2/c1-18(2)8-12-15(13(21)9-18)25-17(19-12)20-14(22)10-24-16(23)11-6-4-3-5-7-11/h3-7H,8-10H2,1-2H3,(H,19,20,22)