1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea Openeye Name: 1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea CAS Name: 1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea IUPAC Name: 1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea Traditional Name: 1-butyl-3-([1,2,4]triazolo[4,3-a]pyridin-3-ylmethyl)thiourea Formula: C12H17N5S MolecularWeight: 263.36188

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=S)NCC1=NN=C2N1C=CC=C2

Isomeric SMILES

CCCCNC(=S)NCC1=NN=C2N1C=CC=C2

InChI

InChI=1S/C12H17N5S/c1-2-3-7-13-12(18)14-9-11-16-15-10-6-4-5-8-17(10)11/h4-6,8H,2-3,7,9H2,1H3,(H2,13,14,18)