1-[3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-indol-2-yl]-2,2-dimethyl-propyl]urea

Systemtic Name: 1-[3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-indol-2-yl]-2,2-dimethyl-propyl]urea Openeye Name: [3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-isopropyl-indol-2-yl]-2,2-dimethyl-propyl]urea CAS Name: [3-[3-(tert-butylthio)-1-[(4-chlorophenyl)methyl]-5-propan-2-yl-2-indolyl]-2,2-dimethylpropyl]urea IUPAC Name: [3-[3-tert-butylsulfanyl-1-[(4-chlorophenyl)methyl]-5-propan-2-ylindol-2-yl]-2,2-dimethylpropyl]urea Traditional Name: [3-[3-(tert-butylthio)-1-(4-chlorobenzyl)-5-isopropyl-indol-2-yl]-2,2-dimethyl-propyl]urea Formula: C28H38ClN3OS MolecularWeight: 500.13882

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)CNC(=O)N)CC3=CC=C(C=C3)Cl

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)N(C(=C2SC(C)(C)C)CC(C)(C)CNC(=O)N)CC3=CC=C(C=C3)Cl

InChI

InChI=1S/C28H38ClN3OS/c1-18(2)20-10-13-23-22(14-20)25(34-27(3,4)5)24(15-28(6,7)17-31-26(30)33)32(23)16-19-8-11-21(29)12-9-19/h8-14,18H,15-17H2,1-7H3,(H3,30,31,33)