N-(5-chloranylpyridin-2-yl)-1-[[5-[(E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidine-4-carboxamide

Systemtic Name: N-(5-chloranylpyridin-2-yl)-1-[[5-[(E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidine-4-carboxamide Openeye Name: N-(5-chloro-2-pyridyl)-1-[5-[(E)-2-(2-furyl)vinyl]-3-methyl-isoxazol-4-yl]sulfonyl-piperidine-4-carboxamide CAS Name: N-(5-chloro-2-pyridinyl)-1-[[5-[(E)-2-(2-furanyl)ethenyl]-3-methyl-4-isoxazolyl]sulfonyl]-4-piperidinecarboxamide IUPAC Name: N-(5-chloropyridin-2-yl)-1-[[5-[(E)-2-(furan-2-yl)ethenyl]-3-methyl-1,2-oxazol-4-yl]sulfonyl]piperidine-4-carboxamide Traditional Name: N-(5-chloro-2-pyridyl)-1-[5-[(E)-2-(2-furyl)vinyl]-3-methyl-isoxazol-4-yl]sulfonyl-isonipecotamide Formula: C21H21ClN4O5S MolecularWeight: 476.93324

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NOC(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl)C=CC4=CC=CO4

Isomeric SMILES

CC1=NOC(=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3=NC=C(C=C3)Cl)/C=C/C4=CC=CO4

InChI

InChI=1S/C21H21ClN4O5S/c1-14-20(18(31-25-14)6-5-17-3-2-12-30-17)32(28,29)26-10-8-15(9-11-26)21(27)24-19-7-4-16(22)13-23-19/h2-7,12-13,15H,8-11H2,1H3,(H,23,24,27)/b6-5+