N4-phenyl-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidine-2,4-diamine

Systemtic Name: N4-phenyl-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidine-2,4-diamine Openeye Name: N4-phenyl-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)vinyl]pyrimidine-2,4-diamine CAS Name: N4-phenyl-6-[(E)-2-(2,6,6-trimethyl-1-cyclohexenyl)ethenyl]pyrimidine-2,4-diamine IUPAC Name: 4-N-phenyl-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)ethenyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-6-[(E)-2-(2,6,6-trimethylcyclohexen-1-yl)vinyl]pyrimidin-4-yl]-phenyl-amine Formula: C21H26N4 MolecularWeight: 334.45794

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC2=CC(=NC(=N2)N)NC3=CC=CC=C3

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C2=CC(=NC(=N2)N)NC3=CC=CC=C3

InChI

InChI=1S/C21H26N4/c1-15-8-7-13-21(2,3)18(15)12-11-17-14-19(25-20(22)24-17)23-16-9-5-4-6-10-16/h4-6,9-12,14H,7-8,13H2,1-3H3,(H3,22,23,24,25)/b12-11+