N-[1-(4-butan-2-ylphenyl)-2-methyl-propyl]-2-chloranyl-5-methylsulfonyl-benzamide

Systemtic Name: N-[1-(4-butan-2-ylphenyl)-2-methyl-propyl]-2-chloranyl-5-methylsulfonyl-benzamide Openeye Name: 2-chloro-N-[2-methyl-1-(4-sec-butylphenyl)propyl]-5-methylsulfonyl-benzamide CAS Name: N-[1-(4-butan-2-ylphenyl)-2-methylpropyl]-2-chloro-5-methylsulfonylbenzamide IUPAC Name: N-[1-(4-butan-2-ylphenyl)-2-methylpropyl]-2-chloro-5-methylsulfonylbenzamide Traditional Name: 2-chloro-5-mesyl-N-[2-methyl-1-(4-sec-butylphenyl)propyl]benzamide Formula: C22H28ClNO3S MolecularWeight: 421.98062

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=C(C=C1)C(C(C)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

Isomeric SMILES

CCC(C)C1=CC=C(C=C1)C(C(C)C)NC(=O)C2=C(C=CC(=C2)S(=O)(=O)C)Cl

InChI

InChI=1S/C22H28ClNO3S/c1-6-15(4)16-7-9-17(10-8-16)21(14(2)3)24-22(25)19-13-18(28(5,26)27)11-12-20(19)23/h7-15,21H,6H2,1-5H3,(H,24,25)