3-chloranyl-N-[2-[[1-(furan-3-ylcarbonyl)piperidin-4-yl]amino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide

Systemtic Name: 3-chloranyl-N-[2-[[1-(furan-3-ylcarbonyl)piperidin-4-yl]amino]-2-oxidanylidene-ethyl]-1-benzothiophene-2-carboxamide Openeye Name: 3-chloro-N-[2-[[1-(furan-3-carbonyl)-4-piperidyl]amino]-2-oxo-ethyl]benzothiophene-2-carboxamide CAS Name: 3-chloro-N-[2-[[1-[3-furanyl(oxo)methyl]-4-piperidinyl]amino]-2-oxoethyl]-1-benzothiophene-2-carboxamide IUPAC Name: 3-chloro-N-[2-[[1-(furan-3-carbonyl)piperidin-4-yl]amino]-2-oxoethyl]-1-benzothiophene-2-carboxamide Traditional Name: 3-chloro-N-[2-[[1-(3-furoyl)-4-piperidyl]amino]-2-keto-ethyl]benzothiophene-2-carboxamide Formula: C21H20ClN3O4S MolecularWeight: 445.9192

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)C4=COC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CNC(=O)C2=C(C3=CC=CC=C3S2)Cl)C(=O)C4=COC=C4

InChI

InChI=1S/C21H20ClN3O4S/c22-18-15-3-1-2-4-16(15)30-19(18)20(27)23-11-17(26)24-14-5-8-25(9-6-14)21(28)13-7-10-29-12-13/h1-4,7,10,12,14H,5-6,8-9,11H2,(H,23,27)(H,24,26)