3-ethoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 3-ethoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Openeye Name: 3-ethoxy-N-[[2-(1-piperidyl)phenyl]carbamothioyl]benzamide CAS Name: 3-ethoxy-N-[[2-(1-piperidinyl)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-ethoxy-N-[(2-piperidin-1-ylphenyl)carbamothioyl]benzamide Traditional Name: 3-ethoxy-N-[(2-piperidinophenyl)thiocarbamoyl]benzamide Formula: C21H25N3O2S MolecularWeight: 383.5071

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3

Isomeric SMILES

CCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2N3CCCCC3

InChI

InChI=1S/C21H25N3O2S/c1-2-26-17-10-8-9-16(15-17)20(25)23-21(27)22-18-11-4-5-12-19(18)24-13-6-3-7-14-24/h4-5,8-12,15H,2-3,6-7,13-14H2,1H3,(H2,22,23,25,27)