2-(8-chloranylnaphthalen-1-yl)sulfanyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone

Systemtic Name: 2-(8-chloranylnaphthalen-1-yl)sulfanyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone Openeye Name: 2-[(8-chloro-1-naphthyl)sulfanyl]-1-(4-pyrrolidin-1-yl-1-piperidyl)ethanone CAS Name: 2-[(8-chloro-1-naphthalenyl)thio]-1-[4-(1-pyrrolidinyl)-1-piperidinyl]ethanone IUPAC Name: 2-(8-chloronaphthalen-1-yl)sulfanyl-1-(4-pyrrolidin-1-ylpiperidin-1-yl)ethanone Traditional Name: 2-[(8-chloro-1-naphthyl)thio]-1-(4-pyrrolidinopiperidino)ethanone Formula: C21H25ClN2OS MolecularWeight: 388.954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2CCN(CC2)C(=O)CSC3=CC=CC4=C3C(=CC=C4)Cl

Isomeric SMILES

C1CCN(C1)C2CCN(CC2)C(=O)CSC3=CC=CC4=C3C(=CC=C4)Cl

InChI

InChI=1S/C21H25ClN2OS/c22-18-7-3-5-16-6-4-8-19(21(16)18)26-15-20(25)24-13-9-17(10-14-24)23-11-1-2-12-23/h3-8,17H,1-2,9-15H2