N-[(4-piperidin-1-ylphenyl)carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[(4-piperidin-1-ylphenyl)carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[4-(1-piperidyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-(1-piperidinyl)anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[(4-piperidin-1-ylphenyl)carbamothioyl]-3-propoxybenzamide Traditional Name: N-[(4-piperidinophenyl)thiocarbamoyl]-3-propoxy-benzamide Formula: C22H27N3O2S MolecularWeight: 397.53368

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)N3CCCCC3

InChI

InChI=1S/C22H27N3O2S/c1-2-15-27-20-8-6-7-17(16-20)21(26)24-22(28)23-18-9-11-19(12-10-18)25-13-4-3-5-14-25/h6-12,16H,2-5,13-15H2,1H3,(H2,23,24,26,28)