(4Z)-6-[4-(2-azanylethylamino)-2-methyl-phenyl]-4-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-2-one

Systemtic Name: (4Z)-6-[4-(2-azanylethylamino)-2-methyl-phenyl]-4-(3-methyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-2-one Openeye Name: (4Z)-6-[4-(2-aminoethylamino)-2-methyl-phenyl]-4-(3-methyl-4-oxo-cyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-2-one CAS Name: (4Z)-6-[4-(2-aminoethylamino)-2-methylphenyl]-4-(3-methyl-4-oxo-1-cyclohexa-2,5-dienylidene)-1H-pyrimidin-2-one IUPAC Name: (4Z)-6-[4-(2-aminoethylamino)-2-methylphenyl]-4-(3-methyl-4-oxocyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-2-one Traditional Name: (4Z)-6-[4-(2-aminoethylamino)-2-methyl-phenyl]-4-(4-keto-3-methyl-cyclohexa-2,5-dien-1-ylidene)-1H-pyrimidin-2-one Formula: C20H22N4O2 MolecularWeight: 350.41428

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C2C=C(NC(=O)N2)C3=C(C=C(C=C3)NCCN)C)C=CC1=O

Isomeric SMILES

CC1=C/C(=C\2/C=C(NC(=O)N2)C3=C(C=C(C=C3)NCCN)C)/C=CC1=O

InChI

InChI=1S/C20H22N4O2/c1-12-10-15(22-8-7-21)4-5-16(12)18-11-17(23-20(26)24-18)14-3-6-19(25)13(2)9-14/h3-6,9-11,22H,7-8,21H2,1-2H3,(H2,23,24,26)/b17-14-