4-propoxy-N-[[(2R)-2-pyridin-3-ylpiperidin-1-yl]carbamothioyl]benzamide

Systemtic Name: 4-propoxy-N-[[(2R)-2-pyridin-3-ylpiperidin-1-yl]carbamothioyl]benzamide Openeye Name: 4-propoxy-N-[[(2R)-2-(3-pyridyl)-1-piperidyl]carbamothioyl]benzamide CAS Name: 4-propoxy-N-[[[(2R)-2-(3-pyridinyl)-1-piperidinyl]amino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-propoxy-N-[[(2R)-2-pyridin-3-ylpiperidin-1-yl]carbamothioyl]benzamide Traditional Name: 4-propoxy-N-[[(2R)-2-(3-pyridyl)piperidino]thiocarbamoyl]benzamide Formula: C21H26N4O2S MolecularWeight: 398.52174

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NN2CCCCC2C3=CN=CC=C3

Isomeric SMILES

CCCOC1=CC=C(C=C1)C(=O)NC(=S)NN2CCCC[C@@H]2C3=CN=CC=C3

InChI

InChI=1S/C21H26N4O2S/c1-2-14-27-18-10-8-16(9-11-18)20(26)23-21(28)24-25-13-4-3-7-19(25)17-6-5-12-22-15-17/h5-6,8-12,15,19H,2-4,7,13-14H2,1H3,(H2,23,24,26,28)/t19-/m1/s1