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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)C(=O)NC1=CC(=CC=C1)NC(=S)NC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O2S/c1-26(2,3)24(31)27-20-15-10-16-21(17-20)28-25(32)29-23(30)22(18-11-6-4-7-12-18)19-13-8-5-9-14-19/h4-17,22H,1-3H3,(H,27,31)(H2,28,29,30,32)