[(3S)-3-azanylpyrrolidin-1-yl]-[(2S)-1-(4-pyridin-3-ylphenyl)sulfonylpiperidin-2-yl]methanone

Systemtic Name: [(3S)-3-azanylpyrrolidin-1-yl]-[(2S)-1-(4-pyridin-3-ylphenyl)sulfonylpiperidin-2-yl]methanone Openeye Name: [(3S)-3-aminopyrrolidin-1-yl]-[(2S)-1-[4-(3-pyridyl)phenyl]sulfonyl-2-piperidyl]methanone CAS Name: [(3S)-3-amino-1-pyrrolidinyl]-[(2S)-1-[4-(3-pyridinyl)phenyl]sulfonyl-2-piperidinyl]methanone IUPAC Name: [(3S)-3-aminopyrrolidin-1-yl]-[(2S)-1-(4-pyridin-3-ylphenyl)sulfonylpiperidin-2-yl]methanone Traditional Name: [(3S)-3-aminopyrrolidino]-[(2S)-1-[4-(3-pyridyl)phenyl]sulfonyl-2-piperidyl]methanone Formula: C21H26N4O3S MolecularWeight: 414.52114

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)N2CCC(C2)N)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CC=C4

Isomeric SMILES

C1CCN([C@@H](C1)C(=O)N2CC[C@@H](C2)N)S(=O)(=O)C3=CC=C(C=C3)C4=CN=CC=C4

InChI

InChI=1S/C21H26N4O3S/c22-18-10-13-24(15-18)21(26)20-5-1-2-12-25(20)29(27,28)19-8-6-16(7-9-19)17-4-3-11-23-14-17/h3-4,6-9,11,14,18,20H,1-2,5,10,12-13,15,22H2/t18-,20-/m0/s1