N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propan-2-yl-benzamide

Systemtic Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propan-2-yl-benzamide Openeye Name: N-[(3-isobutoxyphenyl)carbamothioyl]-4-isopropyl-benzamide CAS Name: N-[[3-(2-methylpropoxy)anilino]-sulfanylidenemethyl]-4-propan-2-ylbenzamide IUPAC Name: N-[[3-(2-methylpropoxy)phenyl]carbamothioyl]-4-propan-2-ylbenzamide Traditional Name: N-[(3-isobutoxyphenyl)thiocarbamoyl]-4-isopropyl-benzamide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

Isomeric SMILES

CC(C)COC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)C(C)C

InChI

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