N,N-dimethyl-3-[4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]propanamide

Systemtic Name: N,N-dimethyl-3-[4-[2-(2-methylphenyl)ethanoylcarbamothioylamino]phenyl]propanamide Openeye Name: N,N-dimethyl-3-[4-[[2-(o-tolyl)acetyl]carbamothioylamino]phenyl]propanamide CAS Name: N,N-dimethyl-3-[4-[[[[2-(2-methylphenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: N,N-dimethyl-3-[4-[[2-(2-methylphenyl)acetyl]carbamothioylamino]phenyl]propanamide Traditional Name: N,N-dimethyl-3-[4-[[2-(o-tolyl)acetyl]thiocarbamoylamino]phenyl]propionamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)CCC(=O)N(C)C

Isomeric SMILES

CC1=CC=CC=C1CC(=O)NC(=S)NC2=CC=C(C=C2)CCC(=O)N(C)C

InChI

InChI=1S/C21H25N3O2S/c1-15-6-4-5-7-17(15)14-19(25)23-21(27)22-18-11-8-16(9-12-18)10-13-20(26)24(2)3/h4-9,11-12H,10,13-14H2,1-3H3,(H2,22,23,25,27)