1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromanylpyridin-2-yl)thiourea

Systemtic Name: 1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromanylpyridin-2-yl)thiourea Openeye Name: 1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromo-2-pyridyl)thiourea CAS Name: 1-[2-(2-benzotriazolyl)ethyl]-3-(5-bromo-2-pyridinyl)thiourea IUPAC Name: 1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromopyridin-2-yl)thiourea Traditional Name: 1-[2-(benzotriazol-2-yl)ethyl]-3-(5-bromo-2-pyridyl)thiourea Formula: C14H13BrN6S MolecularWeight: 377.26222

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=NN(N=C2C=C1)CCNC(=S)NC3=NC=C(C=C3)Br

Isomeric SMILES

C1=CC2=NN(N=C2C=C1)CCNC(=S)NC3=NC=C(C=C3)Br

InChI

InChI=1S/C14H13BrN6S/c15-10-5-6-13(17-9-10)18-14(22)16-7-8-21-19-11-3-1-2-4-12(11)20-21/h1-6,9H,7-8H2,(H2,16,17,18,22)