2-(4-fluorophenyl)sulfanyl-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone

Systemtic Name: 2-(4-fluorophenyl)sulfanyl-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone Openeye Name: 2-(4-fluorophenyl)sulfanyl-1-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]ethanone CAS Name: 2-[(4-fluorophenyl)thio]-1-[4-(3-pyridinylmethyl)-1,4-diazepan-1-yl]ethanone IUPAC Name: 2-(4-fluorophenyl)sulfanyl-1-[4-(pyridin-3-ylmethyl)-1,4-diazepan-1-yl]ethanone Traditional Name: 2-[(4-fluorophenyl)thio]-1-[4-(3-pyridylmethyl)-1,4-diazepan-1-yl]ethanone Formula: C19H22FN3OS MolecularWeight: 359.460883

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN(C1)C(=O)CSC2=CC=C(C=C2)F)CC3=CN=CC=C3

Isomeric SMILES

C1CN(CCN(C1)C(=O)CSC2=CC=C(C=C2)F)CC3=CN=CC=C3

InChI

InChI=1S/C19H22FN3OS/c20-17-4-6-18(7-5-17)25-15-19(24)23-10-2-9-22(11-12-23)14-16-3-1-8-21-13-16/h1,3-8,13H,2,9-12,14-15H2