N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide

Systemtic Name: N-[1-(furan-2-ylcarbonyl)piperidin-4-yl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[1-(furan-2-carbonyl)-4-piperidyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[1-[2-furanyl(oxo)methyl]-4-piperidinyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[1-(furan-2-carbonyl)piperidin-4-yl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[1-(2-furoyl)-4-piperidyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C20H21N3O4S MolecularWeight: 399.46344

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(=O)C4=CC=CO4

Isomeric SMILES

C1CN(CCC1NC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C(=O)C4=CC=CO4

InChI

InChI=1S/C20H21N3O4S/c24-18-7-11-28-17-4-3-13(12-15(17)22-18)19(25)21-14-5-8-23(9-6-14)20(26)16-2-1-10-27-16/h1-4,10,12,14H,5-9,11H2,(H,21,25)(H,22,24)