1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylsulfanyl]urea

Systemtic Name: 1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylsulfanyl]urea Openeye Name: 1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylsulfanyl]urea CAS Name: 1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylthio]urea IUPAC Name: 1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylsulfanyl]urea Traditional Name: 1-butyl-3-[2-[2,2-dimethyl-3-(2-methyl-1H-indol-3-yl)cyclopropyl]ethylthio]urea Formula: C21H31N3OS MolecularWeight: 373.55534

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)NSCCC1C(C1(C)C)C2=C(NC3=CC=CC=C32)C

Isomeric SMILES

CCCCNC(=O)NSCCC1C(C1(C)C)C2=C(NC3=CC=CC=C32)C

InChI

InChI=1S/C21H31N3OS/c1-5-6-12-22-20(25)24-26-13-11-16-19(21(16,3)4)18-14(2)23-17-10-8-7-9-15(17)18/h7-10,16,19,23H,5-6,11-13H2,1-4H3,(H2,22,24,25)