N,N-diethyl-5-[(2-fluorophenyl)methyl]-6,11-bis(oxidanylidene)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N,N-diethyl-5-[(2-fluorophenyl)methyl]-6,11-bis(oxidanylidene)benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N,N-diethyl-5-[(2-fluorophenyl)methyl]-6,11-dioxo-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N,N-diethyl-5-[(2-fluorophenyl)methyl]-6,11-dioxo-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N,N-diethyl-5-[(2-fluorophenyl)methyl]-6,11-dioxobenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N,N-diethyl-5-(2-fluorobenzyl)-6,11-diketo-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C25H23FN2O3S MolecularWeight: 450.525123

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)C1=CC2=C(C=C1)S(=O)C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4F

Isomeric SMILES

CCN(CC)C(=O)C1=CC2=C(C=C1)S(=O)C3=CC=CC=C3C(=O)N2CC4=CC=CC=C4F

InChI

InChI=1S/C25H23FN2O3S/c1-3-27(4-2)24(29)17-13-14-23-21(15-17)28(16-18-9-5-7-11-20(18)26)25(30)19-10-6-8-12-22(19)32(23)31/h5-15H,3-4,16H2,1-2H3