3-butoxy-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide

Systemtic Name: 3-butoxy-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-(1-cyanocyclopentyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-(1-cyanocyclopentyl)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[[4-(1-cyanocyclopentyl)phenyl]thiocarbamoyl]benzamide Formula: C24H27N3O2S MolecularWeight: 421.55508

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3(CCCC3)C#N

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C3(CCCC3)C#N

InChI

InChI=1S/C24H27N3O2S/c1-2-3-15-29-21-8-6-7-18(16-21)22(28)27-23(30)26-20-11-9-19(10-12-20)24(17-25)13-4-5-14-24/h6-12,16H,2-5,13-15H2,1H3,(H2,26,27,28,30)