1-[1-(phenylmethyl)piperidin-4-yl]-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea

Systemtic Name: 1-[1-(phenylmethyl)piperidin-4-yl]-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea Openeye Name: 1-(1-benzyl-4-piperidyl)-3-(1-benzyl-2-sulfanyl-ethyl)urea CAS Name: 1-(1-mercapto-3-phenylpropan-2-yl)-3-[1-(phenylmethyl)-4-piperidinyl]urea IUPAC Name: 1-(1-benzylpiperidin-4-yl)-3-(1-phenyl-3-sulfanylpropan-2-yl)urea Traditional Name: 1-(1-benzyl-2-mercapto-ethyl)-3-(1-benzyl-4-piperidyl)urea Formula: C22H29N3OS MolecularWeight: 383.55016

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)NC(CC2=CC=CC=C2)CS)CC3=CC=CC=C3

Isomeric SMILES

C1CN(CCC1NC(=O)NC(CC2=CC=CC=C2)CS)CC3=CC=CC=C3

InChI

InChI=1S/C22H29N3OS/c26-22(24-21(17-27)15-18-7-3-1-4-8-18)23-20-11-13-25(14-12-20)16-19-9-5-2-6-10-19/h1-10,20-21,27H,11-17H2,(H2,23,24,26)