2-[2-[(4-ethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]-N-prop-2-enyl-benzamide

Systemtic Name: 2-[2-[(4-ethylphenyl)-(phenylsulfonyl)amino]ethanoylamino]-N-prop-2-enyl-benzamide Openeye Name: N-allyl-2-[[2-[N-(benzenesulfonyl)-4-ethyl-anilino]acetyl]amino]benzamide CAS Name: 2-[[2-[N-(benzenesulfonyl)-4-ethylanilino]-1-oxoethyl]amino]-N-prop-2-enylbenzamide IUPAC Name: 2-[[2-[N-(benzenesulfonyl)-4-ethylanilino]acetyl]amino]-N-prop-2-enylbenzamide Traditional Name: N-allyl-2-[[2-(N-besyl-4-ethyl-anilino)acetyl]amino]benzamide Formula: C26H27N3O4S MolecularWeight: 477.57528

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCC=C)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CCC1=CC=C(C=C1)N(CC(=O)NC2=CC=CC=C2C(=O)NCC=C)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O4S/c1-3-18-27-26(31)23-12-8-9-13-24(23)28-25(30)19-29(21-16-14-20(4-2)15-17-21)34(32,33)22-10-6-5-7-11-22/h3,5-17H,1,4,18-19H2,2H3,(H,27,31)(H,28,30)