4-chloranyl-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide

Systemtic Name: 4-chloranyl-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: 4-chloro-N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: 4-chloro-N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: 4-chloro-N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: 4-chloro-N-[(2S)-2-(2-furyl)-2-pyrrolidino-ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)C4=CC=CO4

Isomeric SMILES

C1CCN(C1)[C@@H](CNC(=O)C2=CC(=C(C=C2)Cl)S(=O)(=O)N3CCCC3)C4=CC=CO4

InChI

InChI=1S/C21H26ClN3O4S/c22-17-8-7-16(14-20(17)30(27,28)25-11-3-4-12-25)21(26)23-15-18(19-6-5-13-29-19)24-9-1-2-10-24/h5-8,13-14,18H,1-4,9-12,15H2,(H,23,26)/t18-/m0/s1