3-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-(furan-3-ylcarbonyl)piperidin-4-yl]propanamide

Systemtic Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-(furan-3-ylcarbonyl)piperidin-4-yl]propanamide Openeye Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-(furan-3-carbonyl)-4-piperidyl]propanamide CAS Name: 3-(1,3-benzothiazol-2-ylthio)-N-[1-[3-furanyl(oxo)methyl]-4-piperidinyl]propanamide IUPAC Name: 3-(1,3-benzothiazol-2-ylsulfanyl)-N-[1-(furan-3-carbonyl)piperidin-4-yl]propanamide Traditional Name: 3-(1,3-benzothiazol-2-ylthio)-N-[1-(3-furoyl)-4-piperidyl]propionamide Formula: C20H21N3O3S2 MolecularWeight: 415.52904

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCSC2=NC3=CC=CC=C3S2)C(=O)C4=COC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CCSC2=NC3=CC=CC=C3S2)C(=O)C4=COC=C4

InChI

InChI=1S/C20H21N3O3S2/c24-18(8-12-27-20-22-16-3-1-2-4-17(16)28-20)21-15-5-9-23(10-6-15)19(25)14-7-11-26-13-14/h1-4,7,11,13,15H,5-6,8-10,12H2,(H,21,24)