[4-methoxy-2-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone

Systemtic Name: [4-methoxy-2-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]oxy-phenyl]-pyrrolidin-1-yl-methanone Openeye Name: [4-methoxy-2-[[1-[(4-methylsulfanylphenyl)methyl]-4-piperidyl]oxy]phenyl]-pyrrolidin-1-yl-methanone CAS Name: [4-methoxy-2-[[1-[[4-(methylthio)phenyl]methyl]-4-piperidinyl]oxy]phenyl]-(1-pyrrolidinyl)methanone IUPAC Name: [4-methoxy-2-[1-[(4-methylsulfanylphenyl)methyl]piperidin-4-yl]oxyphenyl]-pyrrolidin-1-ylmethanone Traditional Name: [4-methoxy-2-[[1-[4-(methylthio)benzyl]-4-piperidyl]oxy]phenyl]-pyrrolidino-methanone Formula: C25H32N2O3S MolecularWeight: 440.59818

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CCN(CC3)CC4=CC=C(C=C4)SC

Isomeric SMILES

COC1=CC(=C(C=C1)C(=O)N2CCCC2)OC3CCN(CC3)CC4=CC=C(C=C4)SC

InChI

InChI=1S/C25H32N2O3S/c1-29-21-7-10-23(25(28)27-13-3-4-14-27)24(17-21)30-20-11-15-26(16-12-20)18-19-5-8-22(31-2)9-6-19/h5-10,17,20H,3-4,11-16,18H2,1-2H3