[3-[(5-azanylidene-7-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenyl] 3-methoxybenzoate

Systemtic Name: [3-[(5-azanylidene-7-oxidanylidene-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenyl] 3-methoxybenzoate Openeye Name: [3-[(5-imino-7-oxo-thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenyl] 3-methoxybenzoate CAS Name: 3-methoxybenzoic acid [3-[(5-imino-7-oxo-6-thiazolo[3,2-a]pyrimidinylidene)methyl]phenyl] ester IUPAC Name: [3-[(5-imino-7-oxo-[1,3]thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenyl] 3-methoxybenzoate Traditional Name: 3-methoxybenzoic acid [3-[(5-imino-7-keto-thiazolo[3,2-a]pyrimidin-6-ylidene)methyl]phenyl] ester Formula: C21H15N3O4S MolecularWeight: 405.4265

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C=C3C(=N)N4C=CSC4=NC3=O

Isomeric SMILES

COC1=CC=CC(=C1)C(=O)OC2=CC=CC(=C2)C=C3C(=N)N4C=CSC4=NC3=O

InChI

InChI=1S/C21H15N3O4S/c1-27-15-6-3-5-14(12-15)20(26)28-16-7-2-4-13(10-16)11-17-18(22)24-8-9-29-21(24)23-19(17)25/h2-12,22H,1H3