4-(2-azanyl-4-propan-2-yloxy-pteridin-6-yl)benzenecarbonitrile

Systemtic Name: 4-(2-azanyl-4-propan-2-yloxy-pteridin-6-yl)benzenecarbonitrile Openeye Name: 4-(2-amino-4-isopropoxy-pteridin-6-yl)benzonitrile CAS Name: 4-(2-amino-4-propan-2-yloxy-6-pteridinyl)benzonitrile IUPAC Name: 4-(2-amino-4-propan-2-yloxypteridin-6-yl)benzonitrile Traditional Name: 4-(2-amino-4-isopropoxy-pteridin-6-yl)benzonitrile Formula: C16H14N6O MolecularWeight: 306.32196

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=NC(=NC2=NC=C(N=C21)C3=CC=C(C=C3)C#N)N

Isomeric SMILES

CC(C)OC1=NC(=NC2=NC=C(N=C21)C3=CC=C(C=C3)C#N)N

InChI

InChI=1S/C16H14N6O/c1-9(2)23-15-13-14(21-16(18)22-15)19-8-12(20-13)11-5-3-10(7-17)4-6-11/h3-6,8-9H,1-2H3,(H2,18,19,21,22)