N-[(E)-1-(4-butylphenyl)ethylideneamino]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-amine

Systemtic Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-amine Openeye Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-amine CAS Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-6-(3,5-dimethyl-1-pyrazolyl)-4-pyrimidinamine IUPAC Name: N-[(E)-1-(4-butylphenyl)ethylideneamino]-6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-amine Traditional Name: [(E)-1-(4-butylphenyl)ethylideneamino]-[6-(3,5-dimethylpyrazol-1-yl)pyrimidin-4-yl]amine Formula: C21H26N6 MolecularWeight: 362.47134

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=NNC2=NC=NC(=C2)N3C(=CC(=N3)C)C)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)/C(=N/NC2=NC=NC(=C2)N3C(=CC(=N3)C)C)/C

InChI

InChI=1S/C21H26N6/c1-5-6-7-18-8-10-19(11-9-18)17(4)24-25-20-13-21(23-14-22-20)27-16(3)12-15(2)26-27/h8-14H,5-7H2,1-4H3,(H,22,23,25)/b24-17+