N-[4-[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanoylamino]phenyl]-3-methyl-butanamide

Systemtic Name: N-[4-[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]ethanoylamino]phenyl]-3-methyl-butanamide Openeye Name: N-[4-[[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]-3-methyl-butanamide CAS Name: N-[4-[[2-[(3,4-dimethylphenyl)sulfonyl-methylamino]-1-oxoethyl]amino]phenyl]-3-methylbutanamide IUPAC Name: N-[4-[[2-[(3,4-dimethylphenyl)sulfonyl-methylamino]acetyl]amino]phenyl]-3-methylbutanamide Traditional Name: N-[4-[[2-[(3,4-dimethylphenyl)sulfonyl-methyl-amino]acetyl]amino]phenyl]-3-methyl-butyramide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)C

Isomeric SMILES

CC1=C(C=C(C=C1)S(=O)(=O)N(C)CC(=O)NC2=CC=C(C=C2)NC(=O)CC(C)C)C

InChI

InChI=1S/C22H29N3O4S/c1-15(2)12-21(26)23-18-7-9-19(10-8-18)24-22(27)14-25(5)30(28,29)20-11-6-16(3)17(4)13-20/h6-11,13,15H,12,14H2,1-5H3,(H,23,26)(H,24,27)