N-(3-methoxypropyl)-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide

Systemtic Name: N-(3-methoxypropyl)-2-[2-[(4-methylphenyl)-methylsulfonyl-amino]butanoylamino]benzamide Openeye Name: N-(3-methoxypropyl)-2-[2-(4-methyl-N-methylsulfonyl-anilino)butanoylamino]benzamide CAS Name: N-(3-methoxypropyl)-2-[[2-(4-methyl-N-methylsulfonylanilino)-1-oxobutyl]amino]benzamide IUPAC Name: N-(3-methoxypropyl)-2-[2-(4-methyl-N-methylsulfonylanilino)butanoylamino]benzamide Traditional Name: 2-[2-(N-mesyl-4-methyl-anilino)butanoylamino]-N-(3-methoxypropyl)benzamide Formula: C23H31N3O5S MolecularWeight: 461.57434

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O5S/c1-5-21(26(32(4,29)30)18-13-11-17(2)12-14-18)23(28)25-20-10-7-6-9-19(20)22(27)24-15-8-16-31-3/h6-7,9-14,21H,5,8,15-16H2,1-4H3,(H,24,27)(H,25,28)