5-[(8-ethoxy-2,2-dimethyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine

Systemtic Name: 5-[(8-ethoxy-2,2-dimethyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine Openeye Name: 5-[(8-ethoxy-2,2-dimethyl-chromen-6-yl)methyl]pyrimidine-2,4-diamine CAS Name: 5-[(8-ethoxy-2,2-dimethyl-1-benzopyran-6-yl)methyl]pyrimidine-2,4-diamine IUPAC Name: 5-[(8-ethoxy-2,2-dimethylchromen-6-yl)methyl]pyrimidine-2,4-diamine Traditional Name: [2-amino-5-[(8-ethoxy-2,2-dimethyl-chromen-6-yl)methyl]pyrimidin-4-yl]amine Formula: C18H22N4O2 MolecularWeight: 326.39288

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C2C(=CC(=C1)CC3=CN=C(N=C3N)N)C=CC(O2)(C)C

Isomeric SMILES

CCOC1=C2C(=CC(=C1)CC3=CN=C(N=C3N)N)C=CC(O2)(C)C

InChI

InChI=1S/C18H22N4O2/c1-4-23-14-9-11(8-13-10-21-17(20)22-16(13)19)7-12-5-6-18(2,3)24-15(12)14/h5-7,9-10H,4,8H2,1-3H3,(H4,19,20,21,22)