2-(2-azanylethylamino)-4-[(3-phenylmethoxyphenyl)amino]pyrimidine-5-carboxamide

Systemtic Name: 2-(2-azanylethylamino)-4-[(3-phenylmethoxyphenyl)amino]pyrimidine-5-carboxamide Openeye Name: 2-(2-aminoethylamino)-4-(3-benzyloxyanilino)pyrimidine-5-carboxamide CAS Name: 2-(2-aminoethylamino)-4-(3-phenylmethoxyanilino)-5-pyrimidinecarboxamide IUPAC Name: 2-(2-aminoethylamino)-4-(3-phenylmethoxyanilino)pyrimidine-5-carboxamide Traditional Name: 2-(2-aminoethylamino)-4-(3-benzoxyanilino)pyrimidine-5-carboxamide Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC3=NC(=NC=C3C(=O)N)NCCN

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)NC3=NC(=NC=C3C(=O)N)NCCN

InChI

InChI=1S/C20H22N6O2/c21-9-10-23-20-24-12-17(18(22)27)19(26-20)25-15-7-4-8-16(11-15)28-13-14-5-2-1-3-6-14/h1-8,11-12H,9-10,13,21H2,(H2,22,27)(H2,23,24,25,26)