N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-ethyl-1,2,3-thiadiazole-5-carboxamide

Systemtic Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-ethyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-ethyl-thiadiazole-5-carboxamide CAS Name: N-[5-(1-azepanylsulfonyl)-2-methoxyphenyl]-4-ethyl-5-thiadiazolecarboxamide IUPAC Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxyphenyl]-4-ethylthiadiazole-5-carboxamide Traditional Name: N-[5-(azepan-1-ylsulfonyl)-2-methoxy-phenyl]-4-ethyl-thiadiazole-5-carboxamide Formula: C18H24N4O4S2 MolecularWeight: 424.53756

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SN=N1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

Isomeric SMILES

CCC1=C(SN=N1)C(=O)NC2=C(C=CC(=C2)S(=O)(=O)N3CCCCCC3)OC

InChI

InChI=1S/C18H24N4O4S2/c1-3-14-17(27-21-20-14)18(23)19-15-12-13(8-9-16(15)26-2)28(24,25)22-10-6-4-5-7-11-22/h8-9,12H,3-7,10-11H2,1-2H3,(H,19,23)