1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(1,2,3,4-tetrazol-1-yl)ethanone

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(1,2,3,4-tetrazol-1-yl)ethanone Openeye Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(tetrazol-1-yl)ethanone CAS Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(1-tetrazolyl)ethanone IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(tetrazol-1-yl)ethanone Traditional Name: 1-(3,4-dihydro-2H-1,5-benzothiazepin-5-yl)-2-(tetrazol-1-yl)ethanone Formula: C12H13N5OS MolecularWeight: 275.32952

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C2SC1)C(=O)CN3C=NN=N3

Isomeric SMILES

C1CN(C2=CC=CC=C2SC1)C(=O)CN3C=NN=N3

InChI

InChI=1S/C12H13N5OS/c18-12(8-16-9-13-14-15-16)17-6-3-7-19-11-5-2-1-4-10(11)17/h1-2,4-5,9H,3,6-8H2