N-[4-[2-(4-butylphenyl)ethanoylamino]-2-chloranyl-phenyl]-3-methylsulfonyl-benzamide

Systemtic Name: N-[4-[2-(4-butylphenyl)ethanoylamino]-2-chloranyl-phenyl]-3-methylsulfonyl-benzamide Openeye Name: N-[4-[[2-(4-butylphenyl)acetyl]amino]-2-chloro-phenyl]-3-methylsulfonyl-benzamide CAS Name: N-[4-[[2-(4-butylphenyl)-1-oxoethyl]amino]-2-chlorophenyl]-3-methylsulfonylbenzamide IUPAC Name: N-[4-[[2-(4-butylphenyl)acetyl]amino]-2-chlorophenyl]-3-methylsulfonylbenzamide Traditional Name: N-[4-[[2-(4-butylphenyl)acetyl]amino]-2-chloro-phenyl]-3-mesyl-benzamide Formula: C26H27ClN2O4S MolecularWeight: 499.02158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)NC2=CC(=C(C=C2)NC(=O)C3=CC(=CC=C3)S(=O)(=O)C)Cl

InChI

InChI=1S/C26H27ClN2O4S/c1-3-4-6-18-9-11-19(12-10-18)15-25(30)28-21-13-14-24(23(27)17-21)29-26(31)20-7-5-8-22(16-20)34(2,32)33/h5,7-14,16-17H,3-4,6,15H2,1-2H3,(H,28,30)(H,29,31)