N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide

Systemtic Name: N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylamino]-4-methylsulfanyl-1-oxidanylidene-butan-2-yl]benzamide Openeye Name: N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylcarbamoyl]-3-methylsulfanyl-propyl]benzamide CAS Name: N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylamino]-4-(methylthio)-1-oxobutan-2-yl]benzamide IUPAC Name: N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylamino]-4-methylsulfanyl-1-oxobutan-2-yl]benzamide Traditional Name: N-[1-[2-[(4-methoxyphenyl)sulfonylamino]ethylcarbamoyl]-3-(methylthio)propyl]benzamide Formula: C21H27N3O5S2 MolecularWeight: 465.58618

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)NCCNC(=O)C(CCSC)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H27N3O5S2/c1-29-17-8-10-18(11-9-17)31(27,28)23-14-13-22-21(26)19(12-15-30-2)24-20(25)16-6-4-3-5-7-16/h3-11,19,23H,12-15H2,1-2H3,(H,22,26)(H,24,25)