N-[(2,2-diphenylethanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide

Systemtic Name: N-[(2,2-diphenylethanoylamino)carbamothioyl]-3-(2-methylpropoxy)benzamide Openeye Name: N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-isobutoxy-benzamide CAS Name: 3-(2-methylpropoxy)-N-[[(1-oxo-2,2-diphenylethyl)hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[(2,2-diphenylacetyl)amino]carbamothioyl]-3-(2-methylpropoxy)benzamide Traditional Name: N-[[(2,2-diphenylacetyl)amino]thiocarbamoyl]-3-isobutoxy-benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)C(=O)NC(=S)NNC(=O)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-18(2)17-32-22-15-9-14-21(16-22)24(30)27-26(33)29-28-25(31)23(19-10-5-3-6-11-19)20-12-7-4-8-13-20/h3-16,18,23H,17H2,1-2H3,(H,28,31)(H2,27,29,30,33)