1-(4-methylpiperazin-1-yl)-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea

Systemtic Name: 1-(4-methylpiperazin-1-yl)-3-(1-phenyl-3-sulfanyl-propan-2-yl)urea Openeye Name: 1-(1-benzyl-2-sulfanyl-ethyl)-3-(4-methylpiperazin-1-yl)urea CAS Name: 1-(1-mercapto-3-phenylpropan-2-yl)-3-(4-methyl-1-piperazinyl)urea IUPAC Name: 1-(4-methylpiperazin-1-yl)-3-(1-phenyl-3-sulfanylpropan-2-yl)urea Traditional Name: 1-(1-benzyl-2-mercapto-ethyl)-3-(4-methylpiperazino)urea Formula: C15H24N4OS MolecularWeight: 308.44226

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)NC(=O)NC(CC2=CC=CC=C2)CS

Isomeric SMILES

CN1CCN(CC1)NC(=O)NC(CC2=CC=CC=C2)CS

InChI

InChI=1S/C15H24N4OS/c1-18-7-9-19(10-8-18)17-15(20)16-14(12-21)11-13-5-3-2-4-6-13/h2-6,14,21H,7-12H2,1H3,(H2,16,17,20)