1-[1-hydroxyethyl-(8-phenylmethoxy-4-thiomorpholin-4-yl-pyrimido[5,4-d]pyrimidin-2-yl)amino]ethanol

Systemtic Name: 1-[1-hydroxyethyl-(8-phenylmethoxy-4-thiomorpholin-4-yl-pyrimido[5,4-d]pyrimidin-2-yl)amino]ethanol Openeye Name: 1-[(8-benzyloxy-4-thiomorpholino-pyrimido[5,4-d]pyrimidin-2-yl)-(1-hydroxyethyl)amino]ethanol CAS Name: 1-[1-hydroxyethyl-(8-phenylmethoxy-4-thiomorpholin-4-yl-2-pyrimido[5,4-d]pyrimidinyl)amino]ethanol IUPAC Name: 1-[1-hydroxyethyl-(8-phenylmethoxy-4-thiomorpholin-4-ylpyrimido[5,4-d]pyrimidin-2-yl)amino]ethanol Traditional Name: 1-[(8-benzoxy-4-thiomorpholino-pyrimido[5,4-d]pyrimidin-2-yl)-(1-hydroxyethyl)amino]ethanol Formula: C21H26N6O3S MolecularWeight: 442.53454

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Descriptors Computed from Structure

Canonical SMILES:

CC(N(C1=NC2=C(C(=N1)N3CCSCC3)N=CN=C2OCC4=CC=CC=C4)C(C)O)O

Isomeric SMILES

CC(N(C1=NC2=C(C(=N1)N3CCSCC3)N=CN=C2OCC4=CC=CC=C4)C(C)O)O

InChI

InChI=1S/C21H26N6O3S/c1-14(28)27(15(2)29)21-24-18-17(19(25-21)26-8-10-31-11-9-26)22-13-23-20(18)30-12-16-6-4-3-5-7-16/h3-7,13-15,28-29H,8-12H2,1-2H3