4-butoxy-N-[(4-methylpyridin-2-yl)carbamothioyl]benzamide

Systemtic Name: 4-butoxy-N-[(4-methylpyridin-2-yl)carbamothioyl]benzamide Openeye Name: 4-butoxy-N-[(4-methyl-2-pyridyl)carbamothioyl]benzamide CAS Name: 4-butoxy-N-[[(4-methyl-2-pyridinyl)amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-butoxy-N-[(4-methylpyridin-2-yl)carbamothioyl]benzamide Traditional Name: 4-butoxy-N-[(4-methyl-2-pyridyl)thiocarbamoyl]benzamide Formula: C18H21N3O2S MolecularWeight: 343.44324

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=CC(=C2)C

Isomeric SMILES

CCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=NC=CC(=C2)C

InChI

InChI=1S/C18H21N3O2S/c1-3-4-11-23-15-7-5-14(6-8-15)17(22)21-18(24)20-16-12-13(2)9-10-19-16/h5-10,12H,3-4,11H2,1-2H3,(H2,19,20,21,22,24)