N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-5-chloranyl-2-methoxy-benzamide

Systemtic Name: N-[(5-butan-2-yl-2-oxidanyl-phenyl)carbamothioyl]-5-chloranyl-2-methoxy-benzamide Openeye Name: 5-chloro-N-[(2-hydroxy-5-sec-butyl-phenyl)carbamothioyl]-2-methoxy-benzamide CAS Name: N-[(5-butan-2-yl-2-hydroxyanilino)-sulfanylidenemethyl]-5-chloro-2-methoxybenzamide IUPAC Name: N-[(5-butan-2-yl-2-hydroxyphenyl)carbamothioyl]-5-chloro-2-methoxybenzamide Traditional Name: 5-chloro-N-[(2-hydroxy-5-sec-butyl-phenyl)thiocarbamoyl]-2-methoxy-benzamide Formula: C19H21ClN2O3S MolecularWeight: 392.89964

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=C(C=CC(=C2)Cl)OC

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)O)NC(=S)NC(=O)C2=C(C=CC(=C2)Cl)OC

InChI

InChI=1S/C19H21ClN2O3S/c1-4-11(2)12-5-7-16(23)15(9-12)21-19(26)22-18(24)14-10-13(20)6-8-17(14)25-3/h5-11,23H,4H2,1-3H3,(H2,21,22,24,26)