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

Systemtic Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,3-dimethyl-butanamide Openeye Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,3-dimethyl-butanamide CAS Name: N-[3-(1-azepanylsulfonyl)-4-methylphenyl]-3,3-dimethylbutanamide IUPAC Name: N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]-3,3-dimethylbutanamide Traditional Name: N-[3-(azepan-1-ylsulfonyl)-4-methyl-phenyl]-3,3-dimethyl-butyramide Formula: C19H30N2O3S MolecularWeight: 366.5181

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H30N2O3S/c1-15-9-10-16(20-18(22)14-19(2,3)4)13-17(15)25(23,24)21-11-7-5-6-8-12-21/h9-10,13H,5-8,11-12,14H2,1-4H3,(H,20,22)