2-[2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide

Systemtic Name: 2-[2-[(3,4-dimethoxyphenyl)-methylsulfonyl-amino]ethanoylamino]-N-phenethyl-benzamide Openeye Name: 2-[[2-(3,4-dimethoxy-N-methylsulfonyl-anilino)acetyl]amino]-N-phenethyl-benzamide CAS Name: 2-[[2-(3,4-dimethoxy-N-methylsulfonylanilino)-1-oxoethyl]amino]-N-phenethylbenzamide IUPAC Name: 2-[[2-(3,4-dimethoxy-N-methylsulfonylanilino)acetyl]amino]-N-phenethylbenzamide Traditional Name: 2-[[2-(N-mesyl-3,4-dimethoxy-anilino)acetyl]amino]-N-phenethyl-benzamide Formula: C26H29N3O6S MolecularWeight: 511.58996

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)C)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCCC3=CC=CC=C3)S(=O)(=O)C)OC

InChI

InChI=1S/C26H29N3O6S/c1-34-23-14-13-20(17-24(23)35-2)29(36(3,32)33)18-25(30)28-22-12-8-7-11-21(22)26(31)27-16-15-19-9-5-4-6-10-19/h4-14,17H,15-16,18H2,1-3H3,(H,27,31)(H,28,30)