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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-thiophene-2-carboxamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-thiophene-2-carboxamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-methyl-2-thiophenecarboxamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-methylthiophene-2-carboxamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-thiophene-2-carboxamide Formula: C19H24N2O3S2 MolecularWeight: 392.53546

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CS2)C)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2=C(C=CS2)C)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C19H24N2O3S2/c1-14-7-8-16(20-19(22)18-15(2)9-12-25-18)13-17(14)26(23,24)21-10-5-3-4-6-11-21/h7-9,12-13H,3-6,10-11H2,1-2H3,(H,20,22)