5-(1H-imidazol-5-ylmethyl)-2-(naphthalen-1-ylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine

Systemtic Name: 5-(1H-imidazol-5-ylmethyl)-2-(naphthalen-1-ylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine Openeye Name: 5-(1H-imidazol-5-ylmethyl)-2-(1-naphthylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine CAS Name: 5-(1H-imidazol-5-ylmethyl)-2-(1-naphthalenylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine IUPAC Name: 5-(1H-imidazol-5-ylmethyl)-2-(naphthalen-1-ylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine Traditional Name: 5-(1H-imidazol-5-ylmethyl)-2-(1-naphthylmethyl)-3,4-dihydro-1,2,5-benzothiadiazepine Formula: C23H22N4S MolecularWeight: 386.51258

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(SC2=CC=CC=C2N1CC3=CN=CN3)CC4=CC=CC5=CC=CC=C54

Isomeric SMILES

C1CN(SC2=CC=CC=C2N1CC3=CN=CN3)CC4=CC=CC5=CC=CC=C54

InChI

InChI=1S/C23H22N4S/c1-2-9-21-18(6-1)7-5-8-19(21)15-27-13-12-26(16-20-14-24-17-25-20)22-10-3-4-11-23(22)28-27/h1-11,14,17H,12-13,15-16H2,(H,24,25)