3-methyl-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]butanamide

Systemtic Name: 3-methyl-N-[[(4-phenylmethoxyphenyl)carbonylamino]carbamothioyl]butanamide Openeye Name: N-[[(4-benzyloxybenzoyl)amino]carbamothioyl]-3-methyl-butanamide CAS Name: 3-methyl-N-[[[oxo-(4-phenylmethoxyphenyl)methyl]hydrazo]-sulfanylidenemethyl]butanamide IUPAC Name: 3-methyl-N-[[(4-phenylmethoxybenzoyl)amino]carbamothioyl]butanamide Traditional Name: N-[[(4-benzoxybenzoyl)amino]thiocarbamoyl]-3-methyl-butyramide Formula: C20H23N3O3S MolecularWeight: 385.47992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

Isomeric SMILES

CC(C)CC(=O)NC(=S)NNC(=O)C1=CC=C(C=C1)OCC2=CC=CC=C2

InChI

InChI=1S/C20H23N3O3S/c1-14(2)12-18(24)21-20(27)23-22-19(25)16-8-10-17(11-9-16)26-13-15-6-4-3-5-7-15/h3-11,14H,12-13H2,1-2H3,(H,22,25)(H2,21,23,24,27)