5-[5-(azepan-1-ylmethyl)thiophen-2-yl]-3-phenethyl-1,2,4-oxadiazole

Systemtic Name: 5-[5-(azepan-1-ylmethyl)thiophen-2-yl]-3-phenethyl-1,2,4-oxadiazole Openeye Name: 5-[5-(azepan-1-ylmethyl)-2-thienyl]-3-phenethyl-1,2,4-oxadiazole CAS Name: 5-[5-(1-azepanylmethyl)-2-thiophenyl]-3-phenethyl-1,2,4-oxadiazole IUPAC Name: 5-[5-(azepan-1-ylmethyl)thiophen-2-yl]-3-phenethyl-1,2,4-oxadiazole Traditional Name: 5-[5-(azepan-1-ylmethyl)-2-thienyl]-3-phenethyl-1,2,4-oxadiazole Formula: C21H25N3OS MolecularWeight: 367.5077

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=CC=C(S2)C3=NC(=NO3)CCC4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)CC2=CC=C(S2)C3=NC(=NO3)CCC4=CC=CC=C4

InChI

InChI=1S/C21H25N3OS/c1-2-7-15-24(14-6-1)16-18-11-12-19(26-18)21-22-20(23-25-21)13-10-17-8-4-3-5-9-17/h3-5,8-9,11-12H,1-2,6-7,10,13-16H2