N-[4-(2,2-diphenylethanoylcarbamothioylamino)-2-methoxy-phenyl]-2-methyl-propanamide

Systemtic Name: N-[4-(2,2-diphenylethanoylcarbamothioylamino)-2-methoxy-phenyl]-2-methyl-propanamide Openeye Name: N-[4-[(2,2-diphenylacetyl)carbamothioylamino]-2-methoxy-phenyl]-2-methyl-propanamide CAS Name: N-[2-methoxy-4-[[[(1-oxo-2,2-diphenylethyl)amino]-sulfanylidenemethyl]amino]phenyl]-2-methylpropanamide IUPAC Name: N-[4-[(2,2-diphenylacetyl)carbamothioylamino]-2-methoxyphenyl]-2-methylpropanamide Traditional Name: N-[4-[(2,2-diphenylacetyl)thiocarbamoylamino]-2-methoxy-phenyl]-2-methyl-propionamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H27N3O3S/c1-17(2)24(30)28-21-15-14-20(16-22(21)32-3)27-26(33)29-25(31)23(18-10-6-4-7-11-18)19-12-8-5-9-13-19/h4-17,23H,1-3H3,(H,28,30)(H2,27,29,31,33)