4-[[2-[6-oxidanylidene-5-(phenethylamino)-2-phenyl-pyrimidin-1-yl]ethylamino]methyl]benzenecarboximidamide hydrochloride

Systemtic Name: 4-[[2-[6-oxidanylidene-5-(phenethylamino)-2-phenyl-pyrimidin-1-yl]ethylamino]methyl]benzenecarboximidamide hydrochloride Openeye Name: 4-[[2-[6-oxo-5-(phenethylamino)-2-phenyl-pyrimidin-1-yl]ethylamino]methyl]benzamidine hydrochloride CAS Name: 4-[[2-[6-oxo-5-(phenethylamino)-2-phenyl-1-pyrimidinyl]ethylamino]methyl]benzenecarboximidamide hydrochloride IUPAC Name: 4-[[2-[6-oxo-5-(phenethylamino)-2-phenylpyrimidin-1-yl]ethylamino]methyl]benzenecarboximidamide hydrochloride Traditional Name: 4-[[2-[6-keto-5-(phenethylamino)-2-phenyl-pyrimidin-1-yl]ethylamino]methyl]benzamidine hydrochloride Formula: C28H31ClN6O MolecularWeight: 503.03834

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC2=CN=C(N(C2=O)CCNCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4.Cl

Isomeric SMILES

C1=CC=C(C=C1)CCNC2=CN=C(N(C2=O)CCNCC3=CC=C(C=C3)C(=N)N)C4=CC=CC=C4.Cl

InChI

InChI=1S/C28H30N6O.ClH/c29-26(30)23-13-11-22(12-14-23)19-31-17-18-34-27(24-9-5-2-6-10-24)33-20-25(28(34)35)32-16-15-21-7-3-1-4-8-21;/h1-14,20,31-32H,15-19H2,(H3,29,30);1H