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

Systemtic Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-yl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(2S)-2-(2-furyl)-2-pyrrolidin-1-yl-ethyl]-4-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(2S)-2-(2-furanyl)-2-(1-pyrrolidinyl)ethyl]-4-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(2S)-2-(furan-2-yl)-2-pyrrolidin-1-ylethyl]-4-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(2S)-2-(2-furyl)-2-pyrrolidino-ethyl]-4-pyrrolidinosulfonyl-benzamide Formula: C21H27N3O4S MolecularWeight: 417.52178

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H27N3O4S/c25-21(22-16-19(20-6-5-15-28-20)23-11-1-2-12-23)17-7-9-18(10-8-17)29(26,27)24-13-3-4-14-24/h5-10,15,19H,1-4,11-14,16H2,(H,22,25)/t19-/m0/s1