(2-methylsulfanylphenyl)-[1-[[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]methanone

Systemtic Name: (2-methylsulfanylphenyl)-[1-[[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]methanone Openeye Name: (2-methylsulfanylphenyl)-[1-[[5-(pyrrolidin-1-ylmethyl)-2-thienyl]methyl]-3-piperidyl]methanone CAS Name: [2-(methylthio)phenyl]-[1-[[5-(1-pyrrolidinylmethyl)-2-thiophenyl]methyl]-3-piperidinyl]methanone IUPAC Name: (2-methylsulfanylphenyl)-[1-[[5-(pyrrolidin-1-ylmethyl)thiophen-2-yl]methyl]piperidin-3-yl]methanone Traditional Name: [2-(methylthio)phenyl]-[1-[[5-(pyrrolidinomethyl)-2-thienyl]methyl]-3-piperidyl]methanone Formula: C23H30N2OS2 MolecularWeight: 414.6271

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Descriptors Computed from Structure

Canonical SMILES:

CSC1=CC=CC=C1C(=O)C2CCCN(C2)CC3=CC=C(S3)CN4CCCC4

Isomeric SMILES

CSC1=CC=CC=C1C(=O)C2CCCN(C2)CC3=CC=C(S3)CN4CCCC4

InChI

InChI=1S/C23H30N2OS2/c1-27-22-9-3-2-8-21(22)23(26)18-7-6-14-25(15-18)17-20-11-10-19(28-20)16-24-12-4-5-13-24/h2-3,8-11,18H,4-7,12-17H2,1H3