2-(3-methylbutoxy)-N-[[4-(methylcarbamoyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 2-(3-methylbutoxy)-N-[[4-(methylcarbamoyl)phenyl]carbamothioyl]benzamide Openeye Name: 2-isopentyloxy-N-[[4-(methylcarbamoyl)phenyl]carbamothioyl]benzamide CAS Name: 2-(3-methylbutoxy)-N-[[4-(methylcarbamoyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2-(3-methylbutoxy)-N-[[4-(methylcarbamoyl)phenyl]carbamothioyl]benzamide Traditional Name: 2-isoamoxy-N-[[4-(methylcarbamoyl)phenyl]thiocarbamoyl]benzamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC

Isomeric SMILES

CC(C)CCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC

InChI

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