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

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-ethanamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-acetamide CAS Name: N-[5-(1-azepanylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenylacetamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenylacetamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-1,3,4-thiadiazol-2-yl]-2-phenyl-acetamide Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=NN=C(S2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=NN=C(S2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C16H20N4O3S2/c21-14(12-13-8-4-3-5-9-13)17-15-18-19-16(24-15)25(22,23)20-10-6-1-2-7-11-20/h3-5,8-9H,1-2,6-7,10-12H2,(H,17,18,21)