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

Systemtic Name: 1-[(E)-[1-phenyl-2-(1,2,4-triazol-1-yl)ethylidene]amino]thiourea Openeye Name: [(E)-[1-phenyl-2-(1,2,4-triazol-1-yl)ethylidene]amino]thiourea CAS Name: [(E)-[1-phenyl-2-(1,2,4-triazol-1-yl)ethylidene]amino]thiourea IUPAC Name: [(E)-[1-phenyl-2-(1,2,4-triazol-1-yl)ethylidene]amino]thiourea Traditional Name: [(E)-[1-phenyl-2-(1,2,4-triazol-1-yl)ethylidene]amino]thiourea Formula: C11H12N6S MolecularWeight: 260.31818

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=NNC(=S)N)CN2C=NC=N2

Isomeric SMILES

C1=CC=C(C=C1)/C(=N\NC(=S)N)/CN2C=NC=N2

InChI

InChI=1S/C11H12N6S/c12-11(18)16-15-10(6-17-8-13-7-14-17)9-4-2-1-3-5-9/h1-5,7-8H,6H2,(H3,12,16,18)/b15-10-