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3-butoxy-N-(quinolin-5-ylcarbamothioyl)benzamide

3-butoxy-N-(quinolin-5-ylcarbamothioyl)benzamide

Systemtic Name:3-butoxy-N-(quinolin-5-ylcarbamothioyl)benzamide
Openeye Name:3-butoxy-N-(5-quinolylcarbamothioyl)benzamide
CAS Name:3-butoxy-N-[(5-quinolinylamino)-sulfanylidenemethyl]benzamide
IUPAC Name:3-butoxy-N-(quinolin-5-ylcarbamothioyl)benzamide
Traditional Name:3-butoxy-N-(5-quinolylthiocarbamoyl)benzamide
Formula: C21H21N3O2S
MolecularWeight: 379.47534
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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3


Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC3=C2C=CC=N3


InChI

InChI=1S/C21H21N3O2S/c1-2-3-13-26-16-8-4-7-15(14-16)20(25)24-21(27)23-19-11-5-10-18-17(19)9-6-12-22-18/h4-12,14H,2-3,13H2,1H3,(H2,23,24,25,27)


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