N-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide

Systemtic Name: N-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Openeye Name: N-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide CAS Name: N-methyl-6-propyl-3-benzo[b][1,4]benzothiazepinecarboxamide IUPAC Name: N-methyl-6-propylbenzo[b][1,4]benzothiazepine-3-carboxamide Traditional Name: N-methyl-6-propyl-benzo[b][1,4]benzothiazepine-3-carboxamide Formula: C18H18N2OS MolecularWeight: 310.41332

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NC2=C(C=CC(=C2)C(=O)NC)SC3=CC=CC=C31

Isomeric SMILES

CCCC1=NC2=C(C=CC(=C2)C(=O)NC)SC3=CC=CC=C31

InChI

InChI=1S/C18H18N2OS/c1-3-6-14-13-7-4-5-8-16(13)22-17-10-9-12(18(21)19-2)11-15(17)20-14/h4-5,7-11H,3,6H2,1-2H3,(H,19,21)