N-(2-diethylaminoethyl)-4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzamide

Systemtic Name: N-(2-diethylaminoethyl)-4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]benzamide Openeye Name: N-(2-diethylaminoethyl)-4-[[2-(o-tolyl)acetyl]carbamothioylamino]benzamide CAS Name: N-(2-diethylaminoethyl)-4-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-(2-diethylaminoethyl)-4-[[2-(2-methylphenyl)acetyl]carbamothioylamino]benzamide Traditional Name: N-(2-diethylaminoethyl)-4-[[2-(o-tolyl)acetyl]thiocarbamoylamino]benzamide Formula: C23H30N4O2S MolecularWeight: 426.5749

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=S)NC(=O)CC2=CC=CC=C2C

InChI

InChI=1S/C23H30N4O2S/c1-4-27(5-2)15-14-24-22(29)18-10-12-20(13-11-18)25-23(30)26-21(28)16-19-9-7-6-8-17(19)3/h6-13H,4-5,14-16H2,1-3H3,(H,24,29)(H2,25,26,28,30)