2-[4-(azepan-1-ylsulfonyl)phenyl]-5-phenyl-1,3-oxazole

Systemtic Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-phenyl-1,3-oxazole Openeye Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-phenyl-oxazole CAS Name: 2-[4-(1-azepanylsulfonyl)phenyl]-5-phenyloxazole IUPAC Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-phenyl-1,3-oxazole Traditional Name: 2-[4-(azepan-1-ylsulfonyl)phenyl]-5-phenyl-oxazole Formula: C21H22N2O3S MolecularWeight: 382.47598

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC=C(O3)C4=CC=CC=C4

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=CC=C(C=C2)C3=NC=C(O3)C4=CC=CC=C4

InChI

InChI=1S/C21H22N2O3S/c24-27(25,23-14-6-1-2-7-15-23)19-12-10-18(11-13-19)21-22-16-20(26-21)17-8-4-3-5-9-17/h3-5,8-13,16H,1-2,6-7,14-15H2