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6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide

6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name:6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide
Openeye Name:6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide
CAS Name:6-ethyl-8-methyl-N-(3-phenylpropyl)-3-benzo[b][1,4]benzothiazepinecarboxamide
IUPAC Name:6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide
Traditional Name:6-ethyl-8-methyl-N-(3-phenylpropyl)benzo[b][1,4]benzothiazepine-3-carboxamide
Formula: C26H26N2OS
MolecularWeight: 414.56244
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NC2=C(C=CC(=C2)C(=O)NCCCC3=CC=CC=C3)SC4=C1C=C(C=C4)C


Isomeric SMILES

CCC1=NC2=C(C=CC(=C2)C(=O)NCCCC3=CC=CC=C3)SC4=C1C=C(C=C4)C


InChI

InChI=1S/C26H26N2OS/c1-3-22-21-16-18(2)11-13-24(21)30-25-14-12-20(17-23(25)28-22)26(29)27-15-7-10-19-8-5-4-6-9-19/h4-6,8-9,11-14,16-17H,3,7,10,15H2,1-2H3,(H,27,29)


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