N-(2-methoxyethyl)-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-(2-methoxyethyl)-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-(2-methoxyethyl)-2-[2-(4-methyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-(2-methoxyethyl)-2-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-(2-methoxyethyl)-2-[2-(4-methyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: 2-[2-(N-mesyl-4-methyl-anilino)butanoylamino]-N-(2-methoxyethyl)benzamide Formula: C22H29N3O5S MolecularWeight: 447.54776

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC=C1C(=O)NCCOC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

Isomeric SMILES

CCC(C(=O)NC1=CC=CC=C1C(=O)NCCOC)N(C2=CC=C(C=C2)C)S(=O)(=O)C

InChI

InChI=1S/C22H29N3O5S/c1-5-20(25(31(4,28)29)17-12-10-16(2)11-13-17)22(27)24-19-9-7-6-8-18(19)21(26)23-14-15-30-3/h6-13,20H,5,14-15H2,1-4H3,(H,23,26)(H,24,27)