N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-4-(4-methylphenoxy)butanamide

Systemtic Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-4-(4-methylphenoxy)butanamide Openeye Name: N-[(2-ethyl-6-methyl-phenyl)carbamothioyl]-4-(4-methylphenoxy)butanamide CAS Name: N-[(2-ethyl-6-methylanilino)-sulfanylidenemethyl]-4-(4-methylphenoxy)butanamide IUPAC Name: N-[(2-ethyl-6-methylphenyl)carbamothioyl]-4-(4-methylphenoxy)butanamide Traditional Name: N-[(2-ethyl-6-methyl-phenyl)thiocarbamoyl]-4-(4-methylphenoxy)butyramide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC(=C1NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C)C

Isomeric SMILES

CCC1=CC=CC(=C1NC(=S)NC(=O)CCCOC2=CC=C(C=C2)C)C

InChI

InChI=1S/C21H26N2O2S/c1-4-17-8-5-7-16(3)20(17)23-21(26)22-19(24)9-6-14-25-18-12-10-15(2)11-13-18/h5,7-8,10-13H,4,6,9,14H2,1-3H3,(H2,22,23,24,26)