3-butoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[(2-ethyl-6-methylphenyl)carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC=C2CC)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=C(C=CC=C2CC)C

InChI

InChI=1S/C21H26N2O2S/c1-4-6-13-25-18-12-8-11-17(14-18)20(24)23-21(26)22-19-15(3)9-7-10-16(19)5-2/h7-12,14H,4-6,13H2,1-3H3,(H2,22,23,24,26)