N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-butanamide

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-butanamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3-methylbutanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3-methylbutanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3-methyl-butyramide Formula: C18H28N2O3S MolecularWeight: 352.49152

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CC(C)C)S(=O)(=O)N2CCCCCC2

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CC(C)C)S(=O)(=O)N2CCCCCC2

InChI

InChI=1S/C18H28N2O3S/c1-14(2)12-18(21)19-16-9-8-15(3)17(13-16)24(22,23)20-10-6-4-5-7-11-20/h8-9,13-14H,4-7,10-12H2,1-3H3,(H,19,21)