1-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]indole-3-carbaldehyde

Systemtic Name: 1-[(4-azanyl-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]indole-3-carbaldehyde Openeye Name: 1-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]indole-3-carbaldehyde CAS Name: 1-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]-3-indolecarboxaldehyde IUPAC Name: 1-[(4-amino-5-sulfanylidene-1H-1,2,4-triazol-3-yl)methyl]indole-3-carbaldehyde Traditional Name: 1-[(4-amino-5-thioxo-1H-1,2,4-triazol-3-yl)methyl]indole-3-carbaldehyde Formula: C12H11N5OS MolecularWeight: 273.31364

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=CN2CC3=NNC(=S)N3N)C=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=CN2CC3=NNC(=S)N3N)C=O

InChI

InChI=1S/C12H11N5OS/c13-17-11(14-15-12(17)19)6-16-5-8(7-18)9-3-1-2-4-10(9)16/h1-5,7H,6,13H2,(H,15,19)