4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-(5-pyridin-2-ylthiophen-2-yl)sulfonyl-pyrrolidin-3-yl]methyl]piperidin-4-ol

Systemtic Name: 4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-(5-pyridin-2-ylthiophen-2-yl)sulfonyl-pyrrolidin-3-yl]methyl]piperidin-4-ol Openeye Name: 4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-[[5-(2-pyridyl)-2-thienyl]sulfonyl]pyrrolidin-3-yl]methyl]piperidin-4-ol CAS Name: 4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-[[5-(2-pyridinyl)-2-thiophenyl]sulfonyl]-3-pyrrolidinyl]methyl]-4-piperidinol IUPAC Name: 4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-(5-pyridin-2-ylthiophen-2-yl)sulfonylpyrrolidin-3-yl]methyl]piperidin-4-ol Traditional Name: 4-(3-phenylpropyl)-1-[[(3S,4S)-4-phenyl-1-[[5-(2-pyridyl)-2-thienyl]sulfonyl]pyrrolidin-3-yl]methyl]piperidin-4-ol Formula: C34H39N3O3S2 MolecularWeight: 601.82176

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(CCCC2=CC=CC=C2)O)CC3CN(CC3C4=CC=CC=C4)S(=O)(=O)C5=CC=C(S5)C6=CC=CC=N6

Isomeric SMILES

C1CN(CCC1(CCCC2=CC=CC=C2)O)C[C@H]3CN(C[C@@H]3C4=CC=CC=C4)S(=O)(=O)C5=CC=C(S5)C6=CC=CC=N6

InChI

InChI=1S/C34H39N3O3S2/c38-34(18-9-12-27-10-3-1-4-11-27)19-22-36(23-20-34)24-29-25-37(26-30(29)28-13-5-2-6-14-28)42(39,40)33-17-16-32(41-33)31-15-7-8-21-35-31/h1-8,10-11,13-17,21,29-30,38H,9,12,18-20,22-26H2/t29-,30+/m0/s1