2-[[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-1-ol

Systemtic Name: 2-[[4-[(3-methylphenyl)amino]pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-1-ol Openeye Name: 2-[[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-1-ol CAS Name: 2-[[4-(3-methylanilino)-6-pyrimido[5,4-d]pyrimidinyl]amino]-1-propanol IUPAC Name: 2-[[4-(3-methylanilino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-1-ol Traditional Name: 2-[[4-(m-toluidino)pyrimido[5,4-d]pyrimidin-6-yl]amino]propan-1-ol Formula: C16H18N6O MolecularWeight: 310.35372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)NC(C)CO

Isomeric SMILES

CC1=CC(=CC=C1)NC2=NC=NC3=CN=C(N=C32)NC(C)CO

InChI

InChI=1S/C16H18N6O/c1-10-4-3-5-12(6-10)21-15-14-13(18-9-19-15)7-17-16(22-14)20-11(2)8-23/h3-7,9,11,23H,8H2,1-2H3,(H,17,20,22)(H,18,19,21)