N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]pentanamide

Systemtic Name: N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]pentanamide Openeye Name: N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]pentanamide CAS Name: N-[[4-(3-phenylpropoxy)anilino]-sulfanylidenemethyl]pentanamide IUPAC Name: N-[[4-(3-phenylpropoxy)phenyl]carbamothioyl]pentanamide Traditional Name: N-[[4-(3-phenylpropoxy)phenyl]thiocarbamoyl]valeramide Formula: C21H26N2O2S MolecularWeight: 370.50834

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCCCC2=CC=CC=C2

Isomeric SMILES

CCCCC(=O)NC(=S)NC1=CC=C(C=C1)OCCCC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O2S/c1-2-3-11-20(24)23-21(26)22-18-12-14-19(15-13-18)25-16-7-10-17-8-5-4-6-9-17/h4-6,8-9,12-15H,2-3,7,10-11,16H2,1H3,(H2,22,23,24,26)