5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine

Systemtic Name: 5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine Openeye Name: 5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine CAS Name: 5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine IUPAC Name: 5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine Traditional Name: [5-(1H-imidazol-5-ylmethyl)-2-(2-phenylphenyl)-3,4-dihydro-1,2,5-benzothiadiazepin-7-yl]amine Formula: C24H23N5S MolecularWeight: 413.53792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(SC2=C(N1CC3=CN=CN3)C=C(C=C2)N)C4=CC=CC=C4C5=CC=CC=C5

Isomeric SMILES

C1CN(SC2=C(N1CC3=CN=CN3)C=C(C=C2)N)C4=CC=CC=C4C5=CC=CC=C5

InChI

InChI=1S/C24H23N5S/c25-19-10-11-24-23(14-19)28(16-20-15-26-17-27-20)12-13-29(30-24)22-9-5-4-8-21(22)18-6-2-1-3-7-18/h1-11,14-15,17H,12-13,16,25H2,(H,26,27)