N-[4-(azepan-1-ylsulfonyl)phenyl]-5-pyridin-3-yl-1,3,4-oxadiazol-2-amine

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-pyridin-3-yl-1,3,4-oxadiazol-2-amine Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-(3-pyridyl)-1,3,4-oxadiazol-2-amine CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-5-(3-pyridinyl)-1,3,4-oxadiazol-2-amine IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-5-pyridin-3-yl-1,3,4-oxadiazol-2-amine Traditional Name: [4-(azepan-1-ylsulfonyl)phenyl]-[5-(3-pyridyl)-1,3,4-oxadiazol-2-yl]amine Formula: C19H21N5O3S MolecularWeight: 399.46674

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NN=C(O3)C4=CN=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)NC3=NN=C(O3)C4=CN=CC=C4

InChI

InChI=1S/C19H21N5O3S/c25-28(26,24-12-3-1-2-4-13-24)17-9-7-16(8-10-17)21-19-23-22-18(27-19)15-6-5-11-20-14-15/h5-11,14H,1-4,12-13H2,(H,21,23)