N-methyl-4-[[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoylamino]methyl]-N-propan-2-yl-benzamide

Systemtic Name: N-methyl-4-[[2-[(2-methylphenyl)-methylsulfonyl-amino]ethanoylamino]methyl]-N-propan-2-yl-benzamide Openeye Name: N-isopropyl-N-methyl-4-[[[2-(2-methyl-N-methylsulfonyl-anilino)acetyl]amino]methyl]benzamide CAS Name: N-methyl-4-[[[2-(2-methyl-N-methylsulfonylanilino)-1-oxoethyl]amino]methyl]-N-propan-2-ylbenzamide IUPAC Name: N-methyl-4-[[[2-(2-methyl-N-methylsulfonylanilino)acetyl]amino]methyl]-N-propan-2-ylbenzamide Traditional Name: N-isopropyl-4-[[[2-(N-mesyl-2-methyl-anilino)acetyl]amino]methyl]-N-methyl-benzamide Formula: C22H29N3O4S MolecularWeight: 431.54836

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1N(CC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C)S(=O)(=O)C

Isomeric SMILES

CC1=CC=CC=C1N(CC(=O)NCC2=CC=C(C=C2)C(=O)N(C)C(C)C)S(=O)(=O)C

InChI

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