N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-propanamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-propanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-propanamide CAS Name: N-[5-(1-azepanylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxypropanamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxypropanamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenoxy-propionamide Formula: C17H22N4O4S2 MolecularWeight: 410.51098

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=NN=C(S1)S(=O)(=O)N2CCCCCC2)OC3=CC=CC=C3

Isomeric SMILES

CC(C(=O)NC1=NN=C(S1)S(=O)(=O)N2CCCCCC2)OC3=CC=CC=C3

InChI

InChI=1S/C17H22N4O4S2/c1-13(25-14-9-5-4-6-10-14)15(22)18-16-19-20-17(26-16)27(23,24)21-11-7-2-3-8-12-21/h4-6,9-10,13H,2-3,7-8,11-12H2,1H3,(H,18,19,22)