1-[(E)-[4-(5-tert-butyl-1,2,3-triazol-1-yl)phenyl]methylideneamino]thiourea

Systemtic Name: 1-[(E)-[4-(5-tert-butyl-1,2,3-triazol-1-yl)phenyl]methylideneamino]thiourea Openeye Name: [(E)-[4-(5-tert-butyltriazol-1-yl)phenyl]methyleneamino]thiourea CAS Name: [(E)-[4-(5-tert-butyl-1-triazolyl)phenyl]methylideneamino]thiourea IUPAC Name: [(E)-[4-(5-tert-butyltriazol-1-yl)phenyl]methylideneamino]thiourea Traditional Name: [(E)-[4-(5-tert-butyltriazol-1-yl)benzylidene]amino]thiourea Formula: C14H18N6S MolecularWeight: 302.39792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CN=NN1C2=CC=C(C=C2)C=NNC(=S)N

Isomeric SMILES

CC(C)(C)C1=CN=NN1C2=CC=C(C=C2)/C=N/NC(=S)N

InChI

InChI=1S/C14H18N6S/c1-14(2,3)12-9-17-19-20(12)11-6-4-10(5-7-11)8-16-18-13(15)21/h4-9H,1-3H3,(H3,15,18,21)/b16-8+