3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)pyrazol-3-yl]methanone

Systemtic Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)pyrazol-3-yl]methanone Openeye Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)pyrazol-3-yl]methanone CAS Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)-3-pyrazolyl]methanone IUPAC Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)pyrazol-3-yl]methanone Traditional Name: 3,4-dihydro-2H-1,5-benzothiazepin-5-yl-[1-(4-fluorophenyl)pyrazol-3-yl]methanone Formula: C19H16FN3OS MolecularWeight: 353.413243

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)C3=NN(C=C3)C4=CC=C(C=C4)F

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)C3=NN(C=C3)C4=CC=C(C=C4)F

InChI

InChI=1S/C19H16FN3OS/c20-14-6-8-15(9-7-14)23-12-10-16(21-23)19(24)22-11-3-13-25-18-5-2-1-4-17(18)22/h1-2,4-10,12H,3,11,13H2