1-(benzotriazol-1-ylmethyl)-3-phenyl-thiourea

Systemtic Name: 1-(benzotriazol-1-ylmethyl)-3-phenyl-thiourea Openeye Name: 1-(benzotriazol-1-ylmethyl)-3-phenyl-thiourea CAS Name: 1-(1-benzotriazolylmethyl)-3-phenylthiourea IUPAC Name: 1-(benzotriazol-1-ylmethyl)-3-phenylthiourea Traditional Name: 1-(benzotriazol-1-ylmethyl)-3-phenyl-thiourea Formula: C14H13N5S MolecularWeight: 283.35152

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCN2C3=CC=CC=C3N=N2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCN2C3=CC=CC=C3N=N2

InChI

InChI=1S/C14H13N5S/c20-14(16-11-6-2-1-3-7-11)15-10-19-13-9-5-4-8-12(13)17-18-19/h1-9H,10H2,(H2,15,16,20)