1-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1-[2,6-di(propan-2-yl)phenyl]-3-ethyl-3-piperazin-1-yl-urea

Systemtic Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1-[2,6-di(propan-2-yl)phenyl]-3-ethyl-3-piperazin-1-yl-urea Openeye Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1-(2,6-diisopropylphenyl)-3-ethyl-3-piperazin-1-yl-urea CAS Name: 1-[2-(1H-benzimidazol-2-ylthio)ethyl]-1-[2,6-di(propan-2-yl)phenyl]-3-ethyl-3-(1-piperazinyl)urea IUPAC Name: 1-[2-(1H-benzimidazol-2-ylsulfanyl)ethyl]-1-[2,6-di(propan-2-yl)phenyl]-3-ethyl-3-piperazin-1-ylurea Traditional Name: 1-[2-(1H-benzimidazol-2-ylthio)ethyl]-1-(2,6-diisopropylphenyl)-3-ethyl-3-piperazino-urea Formula: C28H40N6OS MolecularWeight: 508.7218

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Descriptors Computed from Structure

Canonical SMILES:

CCN(C(=O)N(CCSC1=NC2=CC=CC=C2N1)C3=C(C=CC=C3C(C)C)C(C)C)N4CCNCC4

Isomeric SMILES

CCN(C(=O)N(CCSC1=NC2=CC=CC=C2N1)C3=C(C=CC=C3C(C)C)C(C)C)N4CCNCC4

InChI

InChI=1S/C28H40N6OS/c1-6-34(32-16-14-29-15-17-32)28(35)33(26-22(20(2)3)10-9-11-23(26)21(4)5)18-19-36-27-30-24-12-7-8-13-25(24)31-27/h7-13,20-21,29H,6,14-19H2,1-5H3,(H,30,31)