[1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone

Systemtic Name: [1-[(3-ethoxy-4-methoxy-phenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone Openeye Name: [1-[(3-ethoxy-4-methoxy-phenyl)methyl]-3-piperidyl]-(2-methylsulfanylphenyl)methanone CAS Name: [1-[(3-ethoxy-4-methoxyphenyl)methyl]-3-piperidinyl]-[2-(methylthio)phenyl]methanone IUPAC Name: [1-[(3-ethoxy-4-methoxyphenyl)methyl]piperidin-3-yl]-(2-methylsulfanylphenyl)methanone Traditional Name: [1-(3-ethoxy-4-methoxy-benzyl)-3-piperidyl]-[2-(methylthio)phenyl]methanone Formula: C23H29NO3S MolecularWeight: 399.54626

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)CN2CCCC(C2)C(=O)C3=CC=CC=C3SC)OC

Isomeric SMILES

CCOC1=C(C=CC(=C1)CN2CCCC(C2)C(=O)C3=CC=CC=C3SC)OC

InChI

InChI=1S/C23H29NO3S/c1-4-27-21-14-17(11-12-20(21)26-2)15-24-13-7-8-18(16-24)23(25)19-9-5-6-10-22(19)28-3/h5-6,9-12,14,18H,4,7-8,13,15-16H2,1-3H3