N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(1-piperidylmethyl)phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-(1-piperidinylmethyl)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(piperidin-1-ylmethyl)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(piperidinomethyl)phenyl]thiocarbamoyl]valeramide Formula: C18H27N3OS MolecularWeight: 333.49148

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)CN2CCCCC2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)CN2CCCCC2

InChI

InChI=1S/C18H27N3OS/c1-2-3-7-17(22)20-18(23)19-16-10-8-15(9-11-16)14-21-12-5-4-6-13-21/h8-11H,2-7,12-14H2,1H3,(H2,19,20,22,23)