N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(furan-3-ylcarbonyl)piperidine-3-carboxamide

Systemtic Name: N-(6-chloranyl-3,4-dihydro-2H-thiochromen-4-yl)-1-(furan-3-ylcarbonyl)piperidine-3-carboxamide Openeye Name: N-(6-chlorothiochroman-4-yl)-1-(furan-3-carbonyl)piperidine-3-carboxamide CAS Name: N-(6-chloro-3,4-dihydro-2H-1-benzothiopyran-4-yl)-1-[3-furanyl(oxo)methyl]-3-piperidinecarboxamide IUPAC Name: N-(6-chloro-3,4-dihydro-2H-thiochromen-4-yl)-1-(furan-3-carbonyl)piperidine-3-carboxamide Traditional Name: N-(6-chlorothiochroman-4-yl)-1-(3-furoyl)nipecotamide Formula: C20H21ClN2O3S MolecularWeight: 404.91034

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)C2=COC=C2)C(=O)NC3CCSC4=C3C=C(C=C4)Cl

Isomeric SMILES

C1CC(CN(C1)C(=O)C2=COC=C2)C(=O)NC3CCSC4=C3C=C(C=C4)Cl

InChI

InChI=1S/C20H21ClN2O3S/c21-15-3-4-18-16(10-15)17(6-9-27-18)22-19(24)13-2-1-7-23(11-13)20(25)14-5-8-26-12-14/h3-5,8,10,12-13,17H,1-2,6-7,9,11H2,(H,22,24)