6-[(4-tert-butylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one

Systemtic Name: 6-[(4-tert-butylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Openeye Name: 6-[(4-tert-butylphenyl)methyl]-3-thioxo-2H-1,2,4-triazin-5-one CAS Name: 6-[(4-tert-butylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one IUPAC Name: 6-[(4-tert-butylphenyl)methyl]-3-sulfanylidene-2H-1,2,4-triazin-5-one Traditional Name: 6-(4-tert-butylbenzyl)-3-thioxo-2H-1,2,4-triazin-5-one Formula: C14H17N3OS MolecularWeight: 275.36928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)CC2=NNC(=S)NC2=O

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)CC2=NNC(=S)NC2=O

InChI

InChI=1S/C14H17N3OS/c1-14(2,3)10-6-4-9(5-7-10)8-11-12(18)15-13(19)17-16-11/h4-7H,8H2,1-3H3,(H2,15,17,18,19)