(E)-3-phenyl-1-[3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]prop-2-en-1-one

Systemtic Name: (E)-3-phenyl-1-[3-[(5-phenyl-1,2,3,4-tetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]prop-2-en-1-one Openeye Name: (E)-3-phenyl-1-[3-[(5-phenyltetrazol-2-yl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]prop-2-en-1-one CAS Name: (E)-3-phenyl-1-[3-[(5-phenyl-2-tetrazolyl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]-2-propen-1-one IUPAC Name: (E)-3-phenyl-1-[3-[(5-phenyltetrazol-2-yl)methyl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]prop-2-en-1-one Traditional Name: (E)-3-phenyl-1-[3-[(5-phenyltetrazol-2-yl)methyl]-5-thioxo-1H-1,2,4-triazol-4-yl]prop-2-en-1-one Formula: C19H15N7OS MolecularWeight: 389.4337

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C=CC(=O)N2C(=NNC2=S)CN3N=C(N=N3)C4=CC=CC=C4

Isomeric SMILES

C1=CC=C(C=C1)/C=C/C(=O)N2C(=NNC2=S)CN3N=C(N=N3)C4=CC=CC=C4

InChI

InChI=1S/C19H15N7OS/c27-17(12-11-14-7-3-1-4-8-14)26-16(20-22-19(26)28)13-25-23-18(21-24-25)15-9-5-2-6-10-15/h1-12H,13H2,(H,22,28)/b12-11+