N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxidanylidene-pyrrolidin-3-yl]-4-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxo-pyrrolidin-3-yl]-4-(1-piperidylsulfonyl)benzamide CAS Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxo-3-pyrrolidinyl]-4-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-oxopyrrolidin-3-yl]-4-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(3S)-1-(3,4-dimethoxyphenyl)-5-keto-pyrrolidin-3-yl]-4-piperidinosulfonyl-benzamide Formula: C24H29N3O6S MolecularWeight: 487.56856

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)N2CC(CC2=O)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

Isomeric SMILES

COC1=C(C=C(C=C1)N2C[C@H](CC2=O)NC(=O)C3=CC=C(C=C3)S(=O)(=O)N4CCCCC4)OC

InChI

InChI=1S/C24H29N3O6S/c1-32-21-11-8-19(15-22(21)33-2)27-16-18(14-23(27)28)25-24(29)17-6-9-20(10-7-17)34(30,31)26-12-4-3-5-13-26/h6-11,15,18H,3-5,12-14,16H2,1-2H3,(H,25,29)/t18-/m0/s1