2-(furan-2-ylmethylsulfanyl)-N-methanoyl-N-[(Z)-2-oxidanyl-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]but-2-enyl]ethanamide

Systemtic Name: 2-(furan-2-ylmethylsulfanyl)-N-methanoyl-N-[(Z)-2-oxidanyl-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]but-2-enyl]ethanamide Openeye Name: N-formyl-2-(2-furylmethylsulfanyl)-N-[(Z)-2-hydroxy-4-[4-(1-piperidylmethyl)-2-pyridyl]but-2-enyl]acetamide CAS Name: N-formyl-2-(2-furanylmethylthio)-N-[(Z)-2-hydroxy-4-[4-(1-piperidinylmethyl)-2-pyridinyl]but-2-enyl]acetamide IUPAC Name: N-formyl-2-(furan-2-ylmethylsulfanyl)-N-[(Z)-2-hydroxy-4-[4-(piperidin-1-ylmethyl)pyridin-2-yl]but-2-enyl]acetamide Traditional Name: N-formyl-2-(2-furfurylthio)-N-[(Z)-2-hydroxy-4-[4-(piperidinomethyl)-2-pyridyl]but-2-enyl]acetamide Formula: C23H29N3O4S MolecularWeight: 443.55906

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)CC2=CC(=NC=C2)CC=C(CN(C=O)C(=O)CSCC3=CC=CO3)O

Isomeric SMILES

C1CCN(CC1)CC2=CC(=NC=C2)C/C=C(/CN(C=O)C(=O)CSCC3=CC=CO3)\O

InChI

InChI=1S/C23H29N3O4S/c27-18-26(23(29)17-31-16-22-5-4-12-30-22)15-21(28)7-6-20-13-19(8-9-24-20)14-25-10-2-1-3-11-25/h4-5,7-9,12-13,18,28H,1-3,6,10-11,14-17H2/b21-7-