5-[[3,4-dimethoxy-5-(1-naphthalen-2-ylethenyl)phenyl]methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[[3,4-dimethoxy-5-(1-naphthalen-2-ylethenyl)phenyl]methyl]pyrimidine-2,4-diamine Openeye Name: 5-[[3,4-dimethoxy-5-[1-(2-naphthyl)vinyl]phenyl]methyl]pyrimidine-2,4-diamine CAS Name: 5-[[3,4-dimethoxy-5-[1-(2-naphthalenyl)ethenyl]phenyl]methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[[3,4-dimethoxy-5-(1-naphthalen-2-ylethenyl)phenyl]methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[3,4-dimethoxy-5-[1-(2-naphthyl)vinyl]benzyl]pyrimidin-4-yl]amine Formula: C25H24N4O2 MolecularWeight: 412.48366

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C(=C)C3=CC4=CC=CC=C4C=C3)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CC2=CN=C(N=C2N)N)C(=C)C3=CC4=CC=CC=C4C=C3)OC

InChI

InChI=1S/C25H24N4O2/c1-15(18-9-8-17-6-4-5-7-19(17)13-18)21-11-16(12-22(30-2)23(21)31-3)10-20-14-28-25(27)29-24(20)26/h4-9,11-14H,1,10H2,2-3H3,(H4,26,27,28,29)