4-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide

Systemtic Name: 4-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide Openeye Name: 4-(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide CAS Name: 4-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide IUPAC Name: 4-(3-propan-2-yl-5-sulfanylidene-1H-1,2,4-triazol-4-yl)benzamide Traditional Name: 4-(3-isopropyl-5-thioxo-1H-1,2,4-triazol-4-yl)benzamide Formula: C12H14N4OS MolecularWeight: 262.33076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NNC(=S)N1C2=CC=C(C=C2)C(=O)N

Isomeric SMILES

CC(C)C1=NNC(=S)N1C2=CC=C(C=C2)C(=O)N

InChI

InChI=1S/C12H14N4OS/c1-7(2)11-14-15-12(18)16(11)9-5-3-8(4-6-9)10(13)17/h3-7H,1-2H3,(H2,13,17)(H,15,18)