5-azanyl-6-[[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one

Systemtic Name: 5-azanyl-6-[[3,5-bis(chloranyl)-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene]methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Openeye Name: 5-amino-6-[(3,5-dichloro-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one CAS Name: 5-amino-6-[(3,5-dichloro-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one IUPAC Name: 5-amino-6-[(3,5-dichloro-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Traditional Name: 5-amino-6-[(3,5-dichloro-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]-2-[(2-methylphenoxy)methyl]-[1,3,4]thiadiazolo[3,2-a]pyrimidin-7-one Formula: C20H14Cl2N4O3S MolecularWeight: 461.32116

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1OCC2=NN3C(=C(C(=O)N=C3S2)C=C4C=C(C(=O)C(=C4)Cl)Cl)N

Isomeric SMILES

CC1=CC=CC=C1OCC2=NN3C(=C(C(=O)N=C3S2)C=C4C=C(C(=O)C(=C4)Cl)Cl)N

InChI

InChI=1S/C20H14Cl2N4O3S/c1-10-4-2-3-5-15(10)29-9-16-25-26-18(23)12(19(28)24-20(26)30-16)6-11-7-13(21)17(27)14(22)8-11/h2-8H,9,23H2,1H3