6-(cyclopentylideneamino)-2-phenyl-N4-(phenylmethyl)pyrimidine-4,5-diamine hydrochloride

Systemtic Name: 6-(cyclopentylideneamino)-2-phenyl-N4-(phenylmethyl)pyrimidine-4,5-diamine hydrochloride Openeye Name: N4-benzyl-6-(cyclopentylideneamino)-2-phenyl-pyrimidine-4,5-diamine hydrochloride CAS Name: 6-(cyclopentylideneamino)-2-phenyl-N4-(phenylmethyl)pyrimidine-4,5-diamine hydrochloride IUPAC Name: 4-N-benzyl-6-(cyclopentylideneamino)-2-phenylpyrimidine-4,5-diamine hydrochloride Traditional Name: [5-amino-6-(cyclopentylideneamino)-2-phenyl-pyrimidin-4-yl]-benzyl-amine hydrochloride Formula: C22H24ClN5 MolecularWeight: 393.91246

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=NC2=C(C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CC=C4)N)C1.Cl

Isomeric SMILES

C1CCC(=NC2=C(C(=NC(=N2)C3=CC=CC=C3)NCC4=CC=CC=C4)N)C1.Cl

InChI

InChI=1S/C22H23N5.ClH/c23-19-21(24-15-16-9-3-1-4-10-16)26-20(17-11-5-2-6-12-17)27-22(19)25-18-13-7-8-14-18;/h1-6,9-12H,7-8,13-15,23H2,(H,24,26,27);1H