1-(2-ethylsulfanylphenyl)-3-[3-(1-pentan-3-ylpiperidin-4-yl)-1H-indol-5-yl]urea

Systemtic Name: 1-(2-ethylsulfanylphenyl)-3-[3-(1-pentan-3-ylpiperidin-4-yl)-1H-indol-5-yl]urea Openeye Name: 1-[3-[1-(1-ethylpropyl)-4-piperidyl]-1H-indol-5-yl]-3-(2-ethylsulfanylphenyl)urea CAS Name: 1-[2-(ethylthio)phenyl]-3-[3-(1-pentan-3-yl-4-piperidinyl)-1H-indol-5-yl]urea IUPAC Name: 1-(2-ethylsulfanylphenyl)-3-[3-(1-pentan-3-ylpiperidin-4-yl)-1H-indol-5-yl]urea Traditional Name: 1-[3-[1-(1-ethylpropyl)-4-piperidyl]-1H-indol-5-yl]-3-[2-(ethylthio)phenyl]urea Formula: C27H36N4OS MolecularWeight: 464.66594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=O)NC4=CC=CC=C4SCC

Isomeric SMILES

CCC(CC)N1CCC(CC1)C2=CNC3=C2C=C(C=C3)NC(=O)NC4=CC=CC=C4SCC

InChI

InChI=1S/C27H36N4OS/c1-4-21(5-2)31-15-13-19(14-16-31)23-18-28-24-12-11-20(17-22(23)24)29-27(32)30-25-9-7-8-10-26(25)33-6-3/h7-12,17-19,21,28H,4-6,13-16H2,1-3H3,(H2,29,30,32)