5-(4-aminophenyl)-4-azanylidene-3,3-dimethyl-1,2,5-benzotriazepin-8-amine tetrahydrochloride

Systemtic Name: 5-(4-aminophenyl)-4-azanylidene-3,3-dimethyl-1,2,5-benzotriazepin-8-amine tetrahydrochloride Openeye Name: 5-(4-aminophenyl)-4-imino-3,3-dimethyl-1,2,5-benzotriazepin-8-amine tetrahydrochloride CAS Name: 5-(4-aminophenyl)-4-imino-3,3-dimethyl-1,2,5-benzotriazepin-8-amine tetrahydrochloride IUPAC Name: 5-(4-aminophenyl)-4-imino-3,3-dimethyl-1,2,5-benzotriazepin-8-amine tetrahydrochloride Traditional Name: [4-(8-amino-4-imino-3,3-dimethyl-1,2,5-benzotriazepin-5-yl)phenyl]amine tetrahydrochloride Formula: C16H22Cl4N6 MolecularWeight: 440.19808

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=N)N(C2=C(C=C(C=C2)N)N=N1)C3=CC=C(C=C3)N)C.Cl.Cl.Cl.Cl

Isomeric SMILES

CC1(C(=N)N(C2=C(C=C(C=C2)N)N=N1)C3=CC=C(C=C3)N)C.Cl.Cl.Cl.Cl

InChI

InChI=1S/C16H18N6.4ClH/c1-16(2)15(19)22(12-6-3-10(17)4-7-12)14-8-5-11(18)9-13(14)20-21-16;;;;/h3-9,19H,17-18H2,1-2H3;4*1H