2-(3-methylbutoxy)-N-[[(4-methylphenyl)carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-(3-methylbutoxy)-N-[[(4-methylphenyl)carbonylamino]carbamothioyl]benzamide Openeye Name: 2-isopentyloxy-N-[[(4-methylbenzoyl)amino]carbamothioyl]benzamide CAS Name: 2-(3-methylbutoxy)-N-[[[(4-methylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[(4-methylbenzoyl)amino]carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: 2-isoamoxy-N-[(p-toluoylamino)thiocarbamoyl]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)NNC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C21H25N3O3S/c1-14(2)12-13-27-18-7-5-4-6-17(18)20(26)22-21(28)24-23-19(25)16-10-8-15(3)9-11-16/h4-11,14H,12-13H2,1-3H3,(H,23,25)(H2,22,24,26,28)