4-chloranyl-6-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-6-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-6-(6-phenyl-2-thioxo-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-6-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-6-(6-phenyl-2-sulfanylidene-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-6-(6-phenyl-2-thioxo-1H-pyrimidin-4-ylidene)cyclohexa-2,4-dien-1-one Formula: C16H11ClN2OS MolecularWeight: 314.78934

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=C3C=C(C=CC3=O)Cl)NC(=S)N2

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=C3C=C(C=CC3=O)Cl)NC(=S)N2

InChI

InChI=1S/C16H11ClN2OS/c17-11-6-7-15(20)12(8-11)14-9-13(18-16(21)19-14)10-4-2-1-3-5-10/h1-9H,(H2,18,19,21)