(3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]amino]azepan-2-one

Systemtic Name: (3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]amino]azepan-2-one Openeye Name: (3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]amino]azepan-2-one CAS Name: (3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-pyridinyl]amino]-2-azepanone IUPAC Name: (3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)pyridin-2-yl]amino]azepan-2-one Traditional Name: (3S)-3-[[5-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-pyridyl]amino]azepan-2-one Formula: C16H19N5O2 MolecularWeight: 313.35436

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC2=NC=C(C=C2)C3=NC(=NO3)C4CC4

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC2=NC=C(C=C2)C3=NC(=NO3)C4CC4

InChI

InChI=1S/C16H19N5O2/c22-15-12(3-1-2-8-17-15)19-13-7-6-11(9-18-13)16-20-14(21-23-16)10-4-5-10/h6-7,9-10,12H,1-5,8H2,(H,17,22)(H,18,19)/t12-/m0/s1