N-[(4-pentylphenyl)carbamothioyl]-3-piperidin-1-yl-propanamide

Systemtic Name: N-[(4-pentylphenyl)carbamothioyl]-3-piperidin-1-yl-propanamide Openeye Name: N-[(4-pentylphenyl)carbamothioyl]-3-(1-piperidyl)propanamide CAS Name: N-[(4-pentylanilino)-sulfanylidenemethyl]-3-(1-piperidinyl)propanamide IUPAC Name: N-[(4-pentylphenyl)carbamothioyl]-3-piperidin-1-ylpropanamide Traditional Name: N-[(4-amylphenyl)thiocarbamoyl]-3-piperidino-propionamide Formula: C20H31N3OS MolecularWeight: 361.54464

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)CCN2CCCCC2

Isomeric SMILES

CCCCCC1=CC=C(C=C1)NC(=S)NC(=O)CCN2CCCCC2

InChI

InChI=1S/C20H31N3OS/c1-2-3-5-8-17-9-11-18(12-10-17)21-20(25)22-19(24)13-16-23-14-6-4-7-15-23/h9-12H,2-8,13-16H2,1H3,(H2,21,22,24,25)