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

Systemtic Name: 5-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-2-phenethyl-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine Openeye Name: 5-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-2-phenethyl-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine CAS Name: 5-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-2-phenethyl-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine IUPAC Name: 5-(1H-imidazol-5-ylmethyl)-N,N-dimethyl-2-phenethyl-3,4-dihydro-1,2,5-benzothiadiazepin-7-amine Traditional Name: [5-(1H-imidazol-5-ylmethyl)-2-phenethyl-3,4-dihydro-1,2,5-benzothiadiazepin-7-yl]-dimethyl-amine Formula: C22H27N5S MolecularWeight: 393.54828

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC2=C(C=C1)SN(CCN2CC3=CN=CN3)CCC4=CC=CC=C4

Isomeric SMILES

CN(C)C1=CC2=C(C=C1)SN(CCN2CC3=CN=CN3)CCC4=CC=CC=C4

InChI

InChI=1S/C22H27N5S/c1-25(2)20-8-9-22-21(14-20)26(16-19-15-23-17-24-19)12-13-27(28-22)11-10-18-6-4-3-5-7-18/h3-9,14-15,17H,10-13,16H2,1-2H3,(H,23,24)