6-[2-azanyl-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propyl-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[2-azanyl-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propyl-cyclohexa-2,4-dien-1-one Openeye Name: 6-[2-amino-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propyl-cyclohexa-2,4-dien-1-one CAS Name: 6-[2-amino-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propyl-1-cyclohexa-2,4-dienone IUPAC Name: 6-[2-amino-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propylcyclohexa-2,4-dien-1-one Traditional Name: 6-[2-amino-5-(4-bromophenyl)-6-methyl-1H-pyrimidin-4-ylidene]-3-methoxy-4-propyl-cyclohexa-2,4-dien-1-one Formula: C21H22BrN3O2 MolecularWeight: 428.32228

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C2C(=C(NC(=N2)N)C)C3=CC=C(C=C3)Br)C(=O)C=C1OC

Isomeric SMILES

CCCC1=CC(=C2C(=C(NC(=N2)N)C)C3=CC=C(C=C3)Br)C(=O)C=C1OC

InChI

InChI=1S/C21H22BrN3O2/c1-4-5-14-10-16(17(26)11-18(14)27-3)20-19(12(2)24-21(23)25-20)13-6-8-15(22)9-7-13/h6-11H,4-5H2,1-3H3,(H3,23,24,25)