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

Systemtic Name: N-[(3,5-dimethylphenyl)carbamothioyl]-3-(3-methylbutoxy)benzamide Openeye Name: N-[(3,5-dimethylphenyl)carbamothioyl]-3-isopentyloxy-benzamide CAS Name: N-[(3,5-dimethylanilino)-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-[(3,5-dimethylphenyl)carbamothioyl]-3-(3-methylbutoxy)benzamide Traditional Name: N-[(3,5-dimethylphenyl)thiocarbamoyl]-3-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(=CC=C2)OCCC(C)C)C

Isomeric SMILES

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

InChI

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