3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide

Systemtic Name: 3-(azepan-1-ylsulfonyl)-4-chloranyl-N-[2-[(2,6-dimethylphenyl)amino]-2-oxidanylidene-ethyl]-N-methyl-benzamide Openeye Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,6-dimethylanilino)-2-oxo-ethyl]-N-methyl-benzamide CAS Name: 3-(1-azepanylsulfonyl)-4-chloro-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylbenzamide IUPAC Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,6-dimethylanilino)-2-oxoethyl]-N-methylbenzamide Traditional Name: 3-(azepan-1-ylsulfonyl)-4-chloro-N-[2-(2,6-dimethylanilino)-2-keto-ethyl]-N-methyl-benzamide Formula: C24H30ClN3O4S MolecularWeight: 492.0307

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

Isomeric SMILES

CC1=C(C(=CC=C1)C)NC(=O)CN(C)C(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCCCC3

InChI

InChI=1S/C24H30ClN3O4S/c1-17-9-8-10-18(2)23(17)26-22(29)16-27(3)24(30)19-11-12-20(25)21(15-19)33(31,32)28-13-6-4-5-7-14-28/h8-12,15H,4-7,13-14,16H2,1-3H3,(H,26,29)