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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-5-methyl-thiophene-2-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-5-methyl-thiophene-2-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)phenyl]-4-ethyl-5-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-5-methylthiophene-2-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)phenyl]-4-ethyl-5-methyl-thiophene-2-carboxamide Formula: C20H26N2O3S2 MolecularWeight: 406.56204

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(SC(=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

Isomeric SMILES

CCC1=C(SC(=C1)C(=O)NC2=CC(=CC=C2)S(=O)(=O)N3CCCCCC3)C

InChI

InChI=1S/C20H26N2O3S2/c1-3-16-13-19(26-15(16)2)20(23)21-17-9-8-10-18(14-17)27(24,25)22-11-6-4-5-7-12-22/h8-10,13-14H,3-7,11-12H2,1-2H3,(H,21,23)