N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide

Systemtic Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide Openeye Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide CAS Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide IUPAC Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide Traditional Name: N-(1-adamantylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine-5-carboxamide Formula: C21H28N2OS MolecularWeight: 356.52482

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)NCC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)NCC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H28N2OS/c24-20(23-6-3-7-25-19-5-2-1-4-18(19)23)22-14-21-11-15-8-16(12-21)10-17(9-15)13-21/h1-2,4-5,15-17H,3,6-14H2,(H,22,24)