[(3S)-3-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-pyridin-3-yl-methanone

Systemtic Name: [(3S)-3-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-pyridin-3-yl-methanone Openeye Name: [(3S)-3-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-(3-pyridyl)methanone CAS Name: [(3S)-3-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)-1-pyrrolidinyl]-(3-pyridinyl)methanone IUPAC Name: [(3S)-3-(5-ethylsulfonyl-1,3-benzoxazol-2-yl)pyrrolidin-1-yl]-pyridin-3-ylmethanone Traditional Name: [(3S)-3-(5-esyl-1,3-benzoxazol-2-yl)pyrrolidino]-(3-pyridyl)methanone Formula: C19H19N3O4S MolecularWeight: 385.43686

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)C3CCN(C3)C(=O)C4=CN=CC=C4

Isomeric SMILES

CCS(=O)(=O)C1=CC2=C(C=C1)OC(=N2)[C@H]3CCN(C3)C(=O)C4=CN=CC=C4

InChI

InChI=1S/C19H19N3O4S/c1-2-27(24,25)15-5-6-17-16(10-15)21-18(26-17)14-7-9-22(12-14)19(23)13-4-3-8-20-11-13/h3-6,8,10-11,14H,2,7,9,12H2,1H3/t14-/m0/s1