4-(1,2,4-triazol-1-yl)pyrimidine-2-carbothialdehyde

Systemtic Name: 4-(1,2,4-triazol-1-yl)pyrimidine-2-carbothialdehyde Openeye Name: 4-(1,2,4-triazol-1-yl)pyrimidine-2-carbothialdehyde CAS Name: 4-(1,2,4-triazol-1-yl)-2-pyrimidinecarbothioaldehyde IUPAC Name: 4-(1,2,4-triazol-1-yl)pyrimidine-2-carbothialdehyde Traditional Name: 4-(1,2,4-triazol-1-yl)pyrimidine-2-carbothialdehyde Formula: C7H5N5S MolecularWeight: 191.2131

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Descriptors Computed from Structure

Canonical SMILES:

C1=CN=C(N=C1N2C=NC=N2)C=S

Isomeric SMILES

C1=CN=C(N=C1N2C=NC=N2)C=S

InChI

InChI=1S/C7H5N5S/c13-3-6-9-2-1-7(11-6)12-5-8-4-10-12/h1-5H