4-[(5-chloranyl-2-methoxy-pyrimidin-4-yl)amino]-5-propan-2-yloxy-1H-quinazolin-7-one

Systemtic Name: 4-[(5-chloranyl-2-methoxy-pyrimidin-4-yl)amino]-5-propan-2-yloxy-1H-quinazolin-7-one Openeye Name: 4-[(5-chloro-2-methoxy-pyrimidin-4-yl)amino]-5-isopropoxy-1H-quinazolin-7-one CAS Name: 4-[(5-chloro-2-methoxy-4-pyrimidinyl)amino]-5-propan-2-yloxy-1H-quinazolin-7-one IUPAC Name: 4-[(5-chloro-2-methoxypyrimidin-4-yl)amino]-5-propan-2-yloxy-1H-quinazolin-7-one Traditional Name: 4-[(5-chloro-2-methoxy-pyrimidin-4-yl)amino]-5-isopropoxy-1H-quinazolin-7-one Formula: C16H16ClN5O3 MolecularWeight: 361.78294

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=O)C=C2C1=C(N=CN2)NC3=NC(=NC=C3Cl)OC

Isomeric SMILES

CC(C)OC1=CC(=O)C=C2C1=C(N=CN2)NC3=NC(=NC=C3Cl)OC

InChI

InChI=1S/C16H16ClN5O3/c1-8(2)25-12-5-9(23)4-11-13(12)15(20-7-19-11)21-14-10(17)6-18-16(22-14)24-3/h4-8H,1-3H3,(H,19,20)(H,18,21,22)