(6Z)-6-[6-[[(2R)-2-azanylpropyl]amino]-1H-pyrimidin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-6-[6-[[(2R)-2-azanylpropyl]amino]-1H-pyrimidin-2-ylidene]-4-chloranyl-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-6-[6-[[(2R)-2-aminopropyl]amino]-1H-pyrimidin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-6-[6-[[(2R)-2-aminopropyl]amino]-1H-pyrimidin-2-ylidene]-4-chloro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-6-[6-[[(2R)-2-aminopropyl]amino]-1H-pyrimidin-2-ylidene]-4-chlorocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-6-[6-[[(2R)-2-aminopropyl]amino]-1H-pyrimidin-2-ylidene]-4-chloro-cyclohexa-2,4-dien-1-one Formula: C13H15ClN4O MolecularWeight: 278.7374

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CNC1=CC=NC(=C2C=C(C=CC2=O)Cl)N1)N

Isomeric SMILES

C[C@H](CNC1=CC=N/C(=C\2/C=C(C=CC2=O)Cl)/N1)N

InChI

InChI=1S/C13H15ClN4O/c1-8(15)7-17-12-4-5-16-13(18-12)10-6-9(14)2-3-11(10)19/h2-6,8,17-18H,7,15H2,1H3/b13-10+/t8-/m1/s1