3,6-bis(chloranyl)-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-yl-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3,6-bis(chloranyl)-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-yl-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3,6-dichloro-N-[(2S)-2-(5-methyl-2-furyl)-2-pyrrolidin-1-yl-ethyl]benzothiophene-2-carboxamide CAS Name: 3,6-dichloro-N-[(2S)-2-(5-methyl-2-furanyl)-2-(1-pyrrolidinyl)ethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3,6-dichloro-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3,6-dichloro-N-[(2S)-2-(5-methyl-2-furyl)-2-pyrrolidino-ethyl]benzothiophene-2-carboxamide Formula: C20H20Cl2N2O2S MolecularWeight: 423.356

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(O1)C(CNC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)N4CCCC4

Isomeric SMILES

CC1=CC=C(O1)[C@H](CNC(=O)C2=C(C3=C(S2)C=C(C=C3)Cl)Cl)N4CCCC4

InChI

InChI=1S/C20H20Cl2N2O2S/c1-12-4-7-16(26-12)15(24-8-2-3-9-24)11-23-20(25)19-18(22)14-6-5-13(21)10-17(14)27-19/h4-7,10,15H,2-3,8-9,11H2,1H3,(H,23,25)/t15-/m0/s1