[5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] thiophene-2-carboxylate

Systemtic Name: [5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-oxidanylidene-2,3-dihydro-1,5-benzothiazepin-3-yl] thiophene-2-carboxylate Openeye Name: [5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] ester IUPAC Name: [5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-oxo-2,3-dihydro-1,5-benzothiazepin-3-yl] thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [5-(2-dimethylaminoethyl)-2-(4-fluorophenyl)-4-keto-2,3-dihydro-1,5-benzothiazepin-3-yl] ester Formula: C24H23FN2O3S2 MolecularWeight: 470.579423

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCN1C2=CC=CC=C2SC(C(C1=O)OC(=O)C3=CC=CS3)C4=CC=C(C=C4)F

Isomeric SMILES

CN(C)CCN1C2=CC=CC=C2SC(C(C1=O)OC(=O)C3=CC=CS3)C4=CC=C(C=C4)F

InChI

InChI=1S/C24H23FN2O3S2/c1-26(2)13-14-27-18-6-3-4-7-19(18)32-22(16-9-11-17(25)12-10-16)21(23(27)28)30-24(29)20-8-5-15-31-20/h3-12,15,21-22H,13-14H2,1-2H3