5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine

Systemtic Name: 5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine Openeye Name: 5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine CAS Name: 5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine IUPAC Name: 5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine Traditional Name: 5-(1,3-benzothiazol-2-ylmethyl)-3,4-dihydro-2H-1,5-benzothiazepine Formula: C17H16N2S2 MolecularWeight: 312.45234

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)CC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)CC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H16N2S2/c1-3-8-15-13(6-1)18-17(21-15)12-19-10-5-11-20-16-9-4-2-7-14(16)19/h1-4,6-9H,5,10-12H2