N-[1-(ethylamino)-4-[(4-methylsulfonylphenyl)carbonylamino]-1-oxidanylidene-butan-2-yl]-4-(hydroxymethyl)benzamide

Systemtic Name: N-[1-(ethylamino)-4-[(4-methylsulfonylphenyl)carbonylamino]-1-oxidanylidene-butan-2-yl]-4-(hydroxymethyl)benzamide Openeye Name: N-[1-(ethylcarbamoyl)-3-[(4-methylsulfonylbenzoyl)amino]propyl]-4-(hydroxymethyl)benzamide CAS Name: N-[1-(ethylamino)-4-[[(4-methylsulfonylphenyl)-oxomethyl]amino]-1-oxobutan-2-yl]-4-(hydroxymethyl)benzamide IUPAC Name: N-[1-(ethylamino)-4-[(4-methylsulfonylbenzoyl)amino]-1-oxobutan-2-yl]-4-(hydroxymethyl)benzamide Traditional Name: N-[1-(ethylcarbamoyl)-3-[(4-mesylbenzoyl)amino]propyl]-4-methylol-benzamide Formula: C22H27N3O6S MolecularWeight: 461.53128

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Descriptors Computed from Structure

Canonical SMILES:

CCNC(=O)C(CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)CO

Isomeric SMILES

CCNC(=O)C(CCNC(=O)C1=CC=C(C=C1)S(=O)(=O)C)NC(=O)C2=CC=C(C=C2)CO

InChI

InChI=1S/C22H27N3O6S/c1-3-23-22(29)19(25-21(28)17-6-4-15(14-26)5-7-17)12-13-24-20(27)16-8-10-18(11-9-16)32(2,30)31/h4-11,19,26H,3,12-14H2,1-2H3,(H,23,29)(H,24,27)(H,25,28)