3-[3-(2,2-diphenylethanoylcarbamothioylamino)phenyl]-N,N-dimethyl-propanamide

Systemtic Name: 3-[3-(2,2-diphenylethanoylcarbamothioylamino)phenyl]-N,N-dimethyl-propanamide Openeye Name: 3-[3-[(2,2-diphenylacetyl)carbamothioylamino]phenyl]-N,N-dimethyl-propanamide CAS Name: N,N-dimethyl-3-[3-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]propanamide IUPAC Name: 3-[3-[(2,2-diphenylacetyl)carbamothioylamino]phenyl]-N,N-dimethylpropanamide Traditional Name: 3-[3-[(2,2-diphenylacetyl)thiocarbamoylamino]phenyl]-N,N-dimethyl-propionamide Formula: C26H27N3O2S MolecularWeight: 445.57648

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CN(C)C(=O)CCC1=CC(=CC=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O2S/c1-29(2)23(30)17-16-19-10-9-15-22(18-19)27-26(32)28-25(31)24(20-11-5-3-6-12-20)21-13-7-4-8-14-21/h3-15,18,24H,16-17H2,1-2H3,(H2,27,28,31,32)