N,N-bis(2-methylpropyl)-6-oxidanylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N,N-bis(2-methylpropyl)-6-oxidanylidene-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N,N-diisobutyl-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N,N-bis(2-methylpropyl)-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide IUPAC Name: N,N-bis(2-methylpropyl)-6-oxo-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N,N-diisobutyl-6-keto-5H-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C22H26N2O2S MolecularWeight: 382.51904

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN(CC(C)C)C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC(C)CN(CC(C)C)C(=O)C1=CC2=C(C=C1)SC3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C22H26N2O2S/c1-14(2)12-24(13-15(3)4)22(26)16-9-10-20-18(11-16)23-21(25)17-7-5-6-8-19(17)27-20/h5-11,14-15H,12-13H2,1-4H3,(H,23,25)