2-chloranyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-5-piperidin-1-ylsulfonyl-benzamide

Systemtic Name: 2-chloranyl-N-[(3S)-1-(phenylmethyl)pyrrolidin-3-yl]-5-piperidin-1-ylsulfonyl-benzamide Openeye Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-2-chloro-5-(1-piperidylsulfonyl)benzamide CAS Name: 2-chloro-N-[(3S)-1-(phenylmethyl)-3-pyrrolidinyl]-5-(1-piperidinylsulfonyl)benzamide IUPAC Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-2-chloro-5-piperidin-1-ylsulfonylbenzamide Traditional Name: N-[(3S)-1-benzylpyrrolidin-3-yl]-2-chloro-5-piperidinosulfonyl-benzamide Formula: C23H28ClN3O3S MolecularWeight: 462.00472

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)NC3CCN(C3)CC4=CC=CC=C4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC(=C(C=C2)Cl)C(=O)N[C@H]3CCN(C3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28ClN3O3S/c24-22-10-9-20(31(29,30)27-12-5-2-6-13-27)15-21(22)23(28)25-19-11-14-26(17-19)16-18-7-3-1-4-8-18/h1,3-4,7-10,15,19H,2,5-6,11-14,16-17H2,(H,25,28)/t19-/m0/s1