6-[2-azanyl-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(4-chlorophenyl)-1H-pyrimidin-6-ylidene]-3-ethoxy-cyclohexa-2,4-dien-1-one Formula: C18H16ClN3O2 MolecularWeight: 341.79154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=O)C(=C2C(=CN=C(N2)N)C3=CC=C(C=C3)Cl)C=C1

Isomeric SMILES

CCOC1=CC(=O)C(=C2C(=CN=C(N2)N)C3=CC=C(C=C3)Cl)C=C1

InChI

InChI=1S/C18H16ClN3O2/c1-2-24-13-7-8-14(16(23)9-13)17-15(10-21-18(20)22-17)11-3-5-12(19)6-4-11/h3-10H,2H2,1H3,(H3,20,21,22)