2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2,4-dimethylpentan-3-yl)butanamide

Systemtic Name: 2-[(3-chlorophenyl)-methylsulfonyl-amino]-N-(2,4-dimethylpentan-3-yl)butanamide Openeye Name: 2-(3-chloro-N-methylsulfonyl-anilino)-N-(1-isopropyl-2-methyl-propyl)butanamide CAS Name: 2-(3-chloro-N-methylsulfonylanilino)-N-(2,4-dimethylpentan-3-yl)butanamide IUPAC Name: 2-(3-chloro-N-methylsulfonylanilino)-N-(2,4-dimethylpentan-3-yl)butanamide Traditional Name: 2-(3-chloro-N-mesyl-anilino)-N-(1-isopropyl-2-methyl-propyl)butyramide Formula: C18H29ClN2O3S MolecularWeight: 388.95246

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC(C(C)C)C(C)C)N(C1=CC(=CC=C1)Cl)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC(C(C)C)C(C)C)N(C1=CC(=CC=C1)Cl)S(=O)(=O)C

InChI

InChI=1S/C18H29ClN2O3S/c1-7-16(18(22)20-17(12(2)3)13(4)5)21(25(6,23)24)15-10-8-9-14(19)11-15/h8-13,16-17H,7H2,1-6H3,(H,20,22)