2,6-dimethyl-N-[(E)-(4-nitrophenyl)methylideneamino]-5-prop-2-enyl-pyrimidin-4-amine hydrochloride

Systemtic Name: 2,6-dimethyl-N-[(E)-(4-nitrophenyl)methylideneamino]-5-prop-2-enyl-pyrimidin-4-amine hydrochloride Openeye Name: 5-allyl-2,6-dimethyl-N-[(E)-(4-nitrophenyl)methyleneamino]pyrimidin-4-amine hydrochloride CAS Name: 2,6-dimethyl-N-[(E)-(4-nitrophenyl)methylideneamino]-5-prop-2-enyl-4-pyrimidinamine hydrochloride IUPAC Name: 2,6-dimethyl-N-[(E)-(4-nitrophenyl)methylideneamino]-5-prop-2-enylpyrimidin-4-amine hydrochloride Traditional Name: (5-allyl-2,6-dimethyl-pyrimidin-4-yl)-[(E)-(4-nitrobenzylidene)amino]amine hydrochloride Formula: C16H18ClN5O2 MolecularWeight: 347.79942

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC(=N1)C)NN=CC2=CC=C(C=C2)[N+](=O)[O-])CC=C.Cl

Isomeric SMILES

CC1=C(C(=NC(=N1)C)N/N=C/C2=CC=C(C=C2)[N+](=O)[O-])CC=C.Cl

InChI

InChI=1S/C16H17N5O2.ClH/c1-4-5-15-11(2)18-12(3)19-16(15)20-17-10-13-6-8-14(9-7-13)21(22)23;/h4,6-10H,1,5H2,2-3H3,(H,18,19,20);1H/b17-10+;