5-[(7,8-dimethoxy-2,2-dimethyl-chromen-5-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(7,8-dimethoxy-2,2-dimethyl-chromen-5-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(7,8-dimethoxy-2,2-dimethyl-chromen-5-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(7,8-dimethoxy-2,2-dimethyl-1-benzopyran-5-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(7,8-dimethoxy-2,2-dimethylchromen-5-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(7,8-dimethoxy-2,2-dimethyl-chromen-5-yl)methyl]pyrimidin-4-yl]amine Formula: C18H22N4O3 MolecularWeight: 342.39228

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C=CC2=C(O1)C(=C(C=C2CC3=CN=C(N=C3N)N)OC)OC)C

Isomeric SMILES

CC1(C=CC2=C(O1)C(=C(C=C2CC3=CN=C(N=C3N)N)OC)OC)C

InChI

InChI=1S/C18H22N4O3/c1-18(2)6-5-12-10(7-11-9-21-17(20)22-16(11)19)8-13(23-3)15(24-4)14(12)25-18/h5-6,8-9H,7H2,1-4H3,(H4,19,20,21,22)