N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-phenylsulfanyl-benzamide

Systemtic Name: N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-phenylsulfanyl-benzamide Openeye Name: N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-phenylsulfanyl-benzamide CAS Name: N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-(phenylthio)benzamide IUPAC Name: N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-phenylsulfanylbenzamide Traditional Name: N-[(1R,3R,4S)-7-azabicyclo[2.2.1]heptan-3-yl]-4-(phenylthio)benzamide Formula: C19H20N2OS MolecularWeight: 324.4399

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Descriptors Computed from Structure

Canonical SMILES:

C1CC2C(CC1N2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

Isomeric SMILES

C1C[C@H]2[C@@H](C[C@@H]1N2)NC(=O)C3=CC=C(C=C3)SC4=CC=CC=C4

InChI

InChI=1S/C19H20N2OS/c22-19(21-18-12-14-8-11-17(18)20-14)13-6-9-16(10-7-13)23-15-4-2-1-3-5-15/h1-7,9-10,14,17-18,20H,8,11-12H2,(H,21,22)/t14-,17+,18-/m1/s1