N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide

Systemtic Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfonyl-1-oxidanylidene-butan-2-yl]-3-methyl-benzamide Openeye Name: N-[1-[2-(4-chlorophenyl)ethylcarbamoyl]-3-methylsulfonyl-propyl]-3-methyl-benzamide CAS Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfonyl-1-oxobutan-2-yl]-3-methylbenzamide IUPAC Name: N-[1-[2-(4-chlorophenyl)ethylamino]-4-methylsulfonyl-1-oxobutan-2-yl]-3-methylbenzamide Traditional Name: N-[1-[2-(4-chlorophenyl)ethylcarbamoyl]-3-mesyl-propyl]-3-methyl-benzamide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)NCCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC(CCS(=O)(=O)C)C(=O)NCCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-15-4-3-5-17(14-15)20(25)24-19(11-13-29(2,27)28)21(26)23-12-10-16-6-8-18(22)9-7-16/h3-9,14,19H,10-13H2,1-2H3,(H,23,26)(H,24,25)