(2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide

Systemtic Name: (2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide Openeye Name: (2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide CAS Name: (2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]propanamide IUPAC Name: (2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]propanamide Traditional Name: (2R)-N-cycloheptyl-2-[[5-(3-nitrophenyl)-1,3,4-oxadiazol-2-yl]thio]propionamide Formula: C18H22N4O4S MolecularWeight: 390.45668

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCCC1)SC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C(=O)NC1CCCCCC1)SC2=NN=C(O2)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O4S/c1-12(16(23)19-14-8-4-2-3-5-9-14)27-18-21-20-17(26-18)13-7-6-10-15(11-13)22(24)25/h6-7,10-12,14H,2-5,8-9H2,1H3,(H,19,23)/t12-/m1/s1