ethyl 4-[4-[1-[4-(4-methoxyphenyl)sulfanylphenyl]ethyl]piperidin-1-yl]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[4-[1-[4-(4-methoxyphenyl)sulfanylphenyl]ethyl]piperidin-1-yl]piperidine-1-carboxylate Openeye Name: ethyl 4-[4-[1-[4-(4-methoxyphenyl)sulfanylphenyl]ethyl]-1-piperidyl]piperidine-1-carboxylate CAS Name: 4-[4-[1-[4-[(4-methoxyphenyl)thio]phenyl]ethyl]-1-piperidinyl]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-[1-[4-(4-methoxyphenyl)sulfanylphenyl]ethyl]piperidin-1-yl]piperidine-1-carboxylate Traditional Name: 4-[4-[1-[4-[(4-methoxyphenyl)thio]phenyl]ethyl]piperidino]piperidine-1-carboxylic acid ethyl ester Formula: C28H38N2O3S MolecularWeight: 482.67792

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)N2CCC(CC2)C(C)C3=CC=C(C=C3)SC4=CC=C(C=C4)OC

Isomeric SMILES

CCOC(=O)N1CCC(CC1)N2CCC(CC2)C(C)C3=CC=C(C=C3)SC4=CC=C(C=C4)OC

InChI

InChI=1S/C28H38N2O3S/c1-4-33-28(31)30-19-15-24(16-20-30)29-17-13-23(14-18-29)21(2)22-5-9-26(10-6-22)34-27-11-7-25(32-3)8-12-27/h5-12,21,23-24H,4,13-20H2,1-3H3