1-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-3-[4-(pyridin-3-ylmethylsulfanyl)phenyl]urea

Systemtic Name: 1-[2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-3-[4-(pyridin-3-ylmethylsulfanyl)phenyl]urea Openeye Name: 1-[2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-3-[4-(3-pyridylmethylsulfanyl)phenyl]urea CAS Name: 1-[2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-3-[4-(3-pyridinylmethylthio)phenyl]urea IUPAC Name: 1-[2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-[4-(pyridin-3-ylmethylsulfanyl)phenyl]urea Traditional Name: 1-[2-(2-furyl)-2-pyrrolidino-ethyl]-3-[4-(3-pyridylmethylthio)phenyl]urea Formula: C23H26N4O2S MolecularWeight: 422.54314

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C4=CC=CO4

Isomeric SMILES

C1CCN(C1)C(CNC(=O)NC2=CC=C(C=C2)SCC3=CN=CC=C3)C4=CC=CO4

InChI

InChI=1S/C23H26N4O2S/c28-23(25-16-21(22-6-4-14-29-22)27-12-1-2-13-27)26-19-7-9-20(10-8-19)30-17-18-5-3-11-24-15-18/h3-11,14-15,21H,1-2,12-13,16-17H2,(H2,25,26,28)