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

Systemtic Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide Openeye Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-yl-ethyl]-3-pyrrolidin-1-ylsulfonyl-benzamide CAS Name: N-[(2S)-2-(4-methoxyphenyl)-2-(1-pyrrolidinyl)ethyl]-3-(1-pyrrolidinylsulfonyl)benzamide IUPAC Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidin-1-ylethyl]-3-pyrrolidin-1-ylsulfonylbenzamide Traditional Name: N-[(2S)-2-(4-methoxyphenyl)-2-pyrrolidino-ethyl]-3-pyrrolidinosulfonyl-benzamide Formula: C24H31N3O4S MolecularWeight: 457.58564

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)N4CCCC4

Isomeric SMILES

COC1=CC=C(C=C1)[C@@H](CNC(=O)C2=CC(=CC=C2)S(=O)(=O)N3CCCC3)N4CCCC4

InChI

InChI=1S/C24H31N3O4S/c1-31-21-11-9-19(10-12-21)23(26-13-2-3-14-26)18-25-24(28)20-7-6-8-22(17-20)32(29,30)27-15-4-5-16-27/h6-12,17,23H,2-5,13-16,18H2,1H3,(H,25,28)/t23-/m1/s1