N-[(3-chlorophenyl)methyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-methyl-butanamide

Systemtic Name: N-[(3-chlorophenyl)methyl]-4-[(4-ethanoylphenyl)sulfonyl-methyl-amino]-N-methyl-butanamide Openeye Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-[(3-chlorophenyl)methyl]-N-methyl-butanamide CAS Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[(3-chlorophenyl)methyl]-N-methylbutanamide IUPAC Name: 4-[(4-acetylphenyl)sulfonyl-methylamino]-N-[(3-chlorophenyl)methyl]-N-methylbutanamide Traditional Name: 4-[(4-acetylphenyl)sulfonyl-methyl-amino]-N-(3-chlorobenzyl)-N-methyl-butyramide Formula: C21H25ClN2O4S MolecularWeight: 436.9522

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)N(C)CC2=CC(=CC=C2)Cl

Isomeric SMILES

CC(=O)C1=CC=C(C=C1)S(=O)(=O)N(C)CCCC(=O)N(C)CC2=CC(=CC=C2)Cl

InChI

InChI=1S/C21H25ClN2O4S/c1-16(25)18-9-11-20(12-10-18)29(27,28)24(3)13-5-8-21(26)23(2)15-17-6-4-7-19(22)14-17/h4,6-7,9-12,14H,5,8,13,15H2,1-3H3