3-(4-phenyl-1,2,3-triazol-1-yl)-2,3-dihydrothiochromen-4-one

Systemtic Name: 3-(4-phenyl-1,2,3-triazol-1-yl)-2,3-dihydrothiochromen-4-one Openeye Name: 3-(4-phenyltriazol-1-yl)thiochroman-4-one CAS Name: 3-(4-phenyl-1-triazolyl)-2,3-dihydro-1-benzothiopyran-4-one IUPAC Name: 3-(4-phenyltriazol-1-yl)-2,3-dihydrothiochromen-4-one Traditional Name: 3-(4-phenyltriazol-1-yl)thiochroman-4-one Formula: C17H13N3OS MolecularWeight: 307.36962

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Descriptors Computed from Structure

Canonical SMILES:

C1C(C(=O)C2=CC=CC=C2S1)N3C=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1C(C(=O)C2=CC=CC=C2S1)N3C=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C17H13N3OS/c21-17-13-8-4-5-9-16(13)22-11-15(17)20-10-14(18-19-20)12-6-2-1-3-7-12/h1-10,15H,11H2