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

Systemtic Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-1,2,3-thiadiazole-5-carboxamide Openeye Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-thiadiazole-5-carboxamide CAS Name: N-[4-(1-azepanylsulfonyl)phenyl]-4-methyl-5-thiadiazolecarboxamide IUPAC Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methylthiadiazole-5-carboxamide Traditional Name: N-[4-(azepan-1-ylsulfonyl)phenyl]-4-methyl-thiadiazole-5-carboxamide Formula: C16H20N4O3S2 MolecularWeight: 380.485

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(SN=N1)C(=O)NC2=CC=C(C=C2)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C16H20N4O3S2/c1-12-15(24-19-18-12)16(21)17-13-6-8-14(9-7-13)25(22,23)20-10-4-2-3-5-11-20/h6-9H,2-5,10-11H2,1H3,(H,17,21)