6-ethyl-N-(furan-2-ylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: 6-ethyl-N-(furan-2-ylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: 6-ethyl-N-(2-furylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: 6-ethyl-N-(2-furanylmethyl)-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: 6-ethyl-N-(furan-2-ylmethyl)benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: 6-ethyl-N-(2-furfuryl)benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C21H18N2O2S MolecularWeight: 362.44482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)SC4=CC=CC=C41

Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NCC3=CC=CO3)SC4=CC=CC=C41

InChI

InChI=1S/C21H18N2O2S/c1-2-17-16-7-3-4-8-19(16)26-20-10-9-14(12-18(20)23-17)21(24)22-13-15-6-5-11-25-15/h3-12H,2,13H2,1H3,(H,22,24)