2-ethylsulfanyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide

Systemtic Name: 2-ethylsulfanyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide Openeye Name: 2-ethylsulfanyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]benzamide CAS Name: 2-(ethylthio)-N-[(2R)-2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]benzamide IUPAC Name: 2-ethylsulfanyl-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]benzamide Traditional Name: 2-(ethylthio)-N-[(2R)-2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]benzamide Formula: C22H28N2O2S MolecularWeight: 384.53492

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)NCC(C2=CC=C(C=C2)OC)N3CCCC3

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)NC[C@@H](C2=CC=C(C=C2)OC)N3CCCC3

InChI

InChI=1S/C22H28N2O2S/c1-3-27-21-9-5-4-8-19(21)22(25)23-16-20(24-14-6-7-15-24)17-10-12-18(26-2)13-11-17/h4-5,8-13,20H,3,6-7,14-16H2,1-2H3,(H,23,25)/t20-/m0/s1