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

Systemtic Name: N-[2-(furan-2-yl)-2-piperidin-1-yl-ethyl]-4-oxidanylidene-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Openeye Name: N-[2-(2-furyl)-2-(1-piperidyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide CAS Name: N-[2-(2-furanyl)-2-(1-piperidinyl)ethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide IUPAC Name: N-[2-(furan-2-yl)-2-piperidin-1-ylethyl]-4-oxo-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Traditional Name: N-[2-(2-furyl)-2-piperidino-ethyl]-4-keto-3,5-dihydro-2H-1,5-benzothiazepine-7-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(CNC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=CC=CO4

Isomeric SMILES

C1CCN(CC1)C(CNC(=O)C2=CC3=C(C=C2)SCCC(=O)N3)C4=CC=CO4

InChI

InChI=1S/C21H25N3O3S/c25-20-8-12-28-19-7-6-15(13-16(19)23-20)21(26)22-14-17(18-5-4-11-27-18)24-9-2-1-3-10-24/h4-7,11,13,17H,1-3,8-10,12,14H2,(H,22,26)(H,23,25)