1-[4-(1,2,4-triazol-1-yl)phenyl]thiourea

Systemtic Name: 1-[4-(1,2,4-triazol-1-yl)phenyl]thiourea Openeye Name: [4-(1,2,4-triazol-1-yl)phenyl]thiourea CAS Name: [4-(1,2,4-triazol-1-yl)phenyl]thiourea IUPAC Name: [4-(1,2,4-triazol-1-yl)phenyl]thiourea Traditional Name: [4-(1,2,4-triazol-1-yl)phenyl]thiourea Formula: C9H9N5S MolecularWeight: 219.26626

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC(=S)N)N2C=NC=N2

Isomeric SMILES

C1=CC(=CC=C1NC(=S)N)N2C=NC=N2

InChI

InChI=1S/C9H9N5S/c10-9(15)13-7-1-3-8(4-2-7)14-6-11-5-12-14/h1-6H,(H3,10,13,15)