4-(3-ethylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one

Systemtic Name: 4-(3-ethylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Openeye Name: 4-(3-ethylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one CAS Name: 4-[3-(ethylthio)-4-phenyl-1H-1,2,4-triazol-5-ylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-(3-ethylsulfanyl-4-phenyl-1H-1,2,4-triazol-5-ylidene)cyclohexa-2,5-dien-1-one Traditional Name: 4-[3-(ethylthio)-4-phenyl-1H-1,2,4-triazol-5-ylidene]cyclohexa-2,5-dien-1-one Formula: C16H15N3OS MolecularWeight: 297.3748

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NNC(=C2C=CC(=O)C=C2)N1C3=CC=CC=C3

Isomeric SMILES

CCSC1=NNC(=C2C=CC(=O)C=C2)N1C3=CC=CC=C3

InChI

InChI=1S/C16H15N3OS/c1-2-21-16-18-17-15(12-8-10-14(20)11-9-12)19(16)13-6-4-3-5-7-13/h3-11,17H,2H2,1H3