N-[3-(azepan-1-yl)butyl]-5-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide

Systemtic Name: N-[3-(azepan-1-yl)butyl]-5-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide Openeye Name: N-[3-(azepan-1-yl)butyl]-5-(4-morpholinosulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide CAS Name: N-[3-(1-azepanyl)butyl]-5-[4-(4-morpholinylsulfonyl)phenyl]-1,3,4-oxadiazole-2-carboxamide IUPAC Name: N-[3-(azepan-1-yl)butyl]-5-(4-morpholin-4-ylsulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide Traditional Name: N-[3-(azepan-1-yl)butyl]-5-(4-morpholinosulfonylphenyl)-1,3,4-oxadiazole-2-carboxamide Formula: C23H33N5O5S MolecularWeight: 491.60362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCNC(=O)C1=NN=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

Isomeric SMILES

CC(CCNC(=O)C1=NN=C(O1)C2=CC=C(C=C2)S(=O)(=O)N3CCOCC3)N4CCCCCC4

InChI

InChI=1S/C23H33N5O5S/c1-18(27-12-4-2-3-5-13-27)10-11-24-21(29)23-26-25-22(33-23)19-6-8-20(9-7-19)34(30,31)28-14-16-32-17-15-28/h6-9,18H,2-5,10-17H2,1H3,(H,24,29)