4-phenoxy-N-[(4-piperidin-1-ylphenyl)carbamothioyl]butanamide

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

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C2=CC=C(C=C2)NC(=S)NC(=O)CCCOC3=CC=CC=C3

InChI

InChI=1S/C22H27N3O2S/c26-21(10-7-17-27-20-8-3-1-4-9-20)24-22(28)23-18-11-13-19(14-12-18)25-15-5-2-6-16-25/h1,3-4,8-9,11-14H,2,5-7,10,15-17H2,(H2,23,24,26,28)