3-methyl-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]benzamide

Systemtic Name: 3-methyl-N-[[[4-(3-methylbutoxy)phenyl]carbonylamino]carbamothioyl]benzamide Openeye Name: N-[[(4-isopentyloxybenzoyl)amino]carbamothioyl]-3-methyl-benzamide CAS Name: 3-methyl-N-[[[[4-(3-methylbutoxy)phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 3-methyl-N-[[[4-(3-methylbutoxy)benzoyl]amino]carbamothioyl]benzamide Traditional Name: N-[[(4-isoamoxybenzoyl)amino]thiocarbamoyl]-3-methyl-benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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