N,N-diethyl-4-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzamide

Systemtic Name: N,N-diethyl-4-[2-[2-[(4-methylphenyl)amino]-2-oxidanylidene-ethyl]sulfanylethanoylamino]benzamide Openeye Name: N,N-diethyl-4-[[2-[2-(4-methylanilino)-2-oxo-ethyl]sulfanylacetyl]amino]benzamide CAS Name: N,N-diethyl-4-[[2-[[2-(4-methylanilino)-2-oxoethyl]thio]-1-oxoethyl]amino]benzamide IUPAC Name: N,N-diethyl-4-[[2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetyl]amino]benzamide Traditional Name: N,N-diethyl-4-[[2-[[2-keto-2-(p-toluidino)ethyl]thio]acetyl]amino]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)C

Isomeric SMILES

CCN(CC)C(=O)C1=CC=C(C=C1)NC(=O)CSCC(=O)NC2=CC=C(C=C2)C

InChI

InChI=1S/C22H27N3O3S/c1-4-25(5-2)22(28)17-8-12-19(13-9-17)24-21(27)15-29-14-20(26)23-18-10-6-16(3)7-11-18/h6-13H,4-5,14-15H2,1-3H3,(H,23,26)(H,24,27)