2-[3-[(2,5-dimethylphenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[3-[(2,5-dimethylphenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[3-[(2,5-dimethylphenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[3-[(2,5-dimethylphenyl)methylthio]-1-indolyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[3-[(2,5-dimethylphenyl)methylsulfanyl]indol-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[3-[(2,5-dimethylbenzyl)thio]indol-1-yl]-1-pyrrolidino-ethanone Formula: C23H26N2OS MolecularWeight: 378.53034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)CSC2=CN(C3=CC=CC=C32)CC(=O)N4CCCC4

Isomeric SMILES

CC1=CC(=C(C=C1)C)CSC2=CN(C3=CC=CC=C32)CC(=O)N4CCCC4

InChI

InChI=1S/C23H26N2OS/c1-17-9-10-18(2)19(13-17)16-27-22-14-25(21-8-4-3-7-20(21)22)15-23(26)24-11-5-6-12-24/h3-4,7-10,13-14H,5-6,11-12,15-16H2,1-2H3