2,4-bis(chloranyl)-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide

Systemtic Name: 2,4-bis(chloranyl)-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Openeye Name: 2,4-dichloro-N-[(3-isopentyloxyphenyl)carbamothioyl]benzamide CAS Name: 2,4-dichloro-N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 2,4-dichloro-N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Traditional Name: 2,4-dichloro-N-[(3-isoamoxyphenyl)thiocarbamoyl]benzamide Formula: C19H20Cl2N2O2S MolecularWeight: 411.3453

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)CCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=C(C=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H20Cl2N2O2S/c1-12(2)8-9-25-15-5-3-4-14(11-15)22-19(26)23-18(24)16-7-6-13(20)10-17(16)21/h3-7,10-12H,8-9H2,1-2H3,(H2,22,23,24,26)