N-[4-(azepan-1-yl)phenyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide

Systemtic Name: N-[4-(azepan-1-yl)phenyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide Openeye Name: N-[4-(azepan-1-yl)phenyl]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propanamide CAS Name: N-[4-(1-azepanyl)phenyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide IUPAC Name: N-[4-(azepan-1-yl)phenyl]-3-(3-thiophen-2-yl-1,2,4-oxadiazol-5-yl)propanamide Traditional Name: N-[4-(azepan-1-yl)phenyl]-3-[3-(2-thienyl)-1,2,4-oxadiazol-5-yl]propionamide Formula: C21H24N4O2S MolecularWeight: 396.50586

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CCC3=NC(=NO3)C4=CC=CS4

Isomeric SMILES

C1CCCN(CC1)C2=CC=C(C=C2)NC(=O)CCC3=NC(=NO3)C4=CC=CS4

InChI

InChI=1S/C21H24N4O2S/c26-19(11-12-20-23-21(24-27-20)18-6-5-15-28-18)22-16-7-9-17(10-8-16)25-13-3-1-2-4-14-25/h5-10,15H,1-4,11-14H2,(H,22,26)