N-[(3,5-dimethylphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide

Systemtic Name: N-[(3,5-dimethylphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Openeye Name: N-[(3,5-dimethylphenyl)carbamothioyl]-4-isopentyloxy-benzamide CAS Name: N-[(3,5-dimethylanilino)-sulfanylidenemethyl]-4-(3-methylbutoxy)benzamide IUPAC Name: N-[(3,5-dimethylphenyl)carbamothioyl]-4-(3-methylbutoxy)benzamide Traditional Name: N-[(3,5-dimethylphenyl)thiocarbamoyl]-4-isoamoxy-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C)C

Isomeric SMILES

CC1=CC(=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OCCC(C)C)C

InChI

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