5-(2-aminophenyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3,4-oxadiazole-2-carboxamide

Systemtic Name: 5-(2-aminophenyl)-N-[(3S)-2-oxidanylideneazepan-3-yl]-1,3,4-oxadiazole-2-carboxamide Openeye Name: 5-(2-aminophenyl)-N-[(3S)-2-oxoazepan-3-yl]-1,3,4-oxadiazole-2-carboxamide CAS Name: 5-(2-aminophenyl)-N-[(3S)-2-oxo-3-azepanyl]-1,3,4-oxadiazole-2-carboxamide IUPAC Name: 5-(2-aminophenyl)-N-[(3S)-2-oxoazepan-3-yl]-1,3,4-oxadiazole-2-carboxamide Traditional Name: 5-(2-aminophenyl)-N-[(3S)-2-ketoazepan-3-yl]-1,3,4-oxadiazole-2-carboxamide Formula: C15H17N5O3 MolecularWeight: 315.32718

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)C2=NN=C(O2)C3=CC=CC=C3N

Isomeric SMILES

C1CCNC(=O)[C@H](C1)NC(=O)C2=NN=C(O2)C3=CC=CC=C3N

InChI

InChI=1S/C15H17N5O3/c16-10-6-2-1-5-9(10)14-19-20-15(23-14)13(22)18-11-7-3-4-8-17-12(11)21/h1-2,5-6,11H,3-4,7-8,16H2,(H,17,21)(H,18,22)/t11-/m0/s1