2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethylsulfanyl]ethyl 4-(2-methoxyphenyl)piperidine-1-carboxylate

Systemtic Name: 2-[2-[(3-chloranyl-1-benzothiophen-2-yl)carbonylamino]ethylsulfanyl]ethyl 4-(2-methoxyphenyl)piperidine-1-carboxylate Openeye Name: 2-[2-[(3-chlorobenzothiophene-2-carbonyl)amino]ethylsulfanyl]ethyl 4-(2-methoxyphenyl)piperidine-1-carboxylate CAS Name: 4-(2-methoxyphenyl)-1-piperidinecarboxylic acid 2-[2-[[(3-chloro-1-benzothiophen-2-yl)-oxomethyl]amino]ethylthio]ethyl ester IUPAC Name: 2-[2-[(3-chloro-1-benzothiophene-2-carbonyl)amino]ethylsulfanyl]ethyl 4-(2-methoxyphenyl)piperidine-1-carboxylate Traditional Name: 4-(2-methoxyphenyl)piperidine-1-carboxylic acid 2-[2-[(3-chlorobenzothiophene-2-carbonyl)amino]ethylthio]ethyl ester Formula: C26H29ClN2O4S2 MolecularWeight: 533.10246

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C2CCN(CC2)C(=O)OCCSCCNC(=O)C3=C(C4=CC=CC=C4S3)Cl

Isomeric SMILES

COC1=CC=CC=C1C2CCN(CC2)C(=O)OCCSCCNC(=O)C3=C(C4=CC=CC=C4S3)Cl

InChI

InChI=1S/C26H29ClN2O4S2/c1-32-21-8-4-2-6-19(21)18-10-13-29(14-11-18)26(31)33-15-17-34-16-12-28-25(30)24-23(27)20-7-3-5-9-22(20)35-24/h2-9,18H,10-17H2,1H3,(H,28,30)