1-hexyl-3-(pyridin-3-ylmethyl)thiourea

Systemtic Name: 1-hexyl-3-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-hexyl-3-(3-pyridylmethyl)thiourea CAS Name: 1-hexyl-3-(3-pyridinylmethyl)thiourea IUPAC Name: 1-hexyl-3-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-hexyl-3-(3-pyridylmethyl)thiourea Formula: C13H21N3S MolecularWeight: 251.39094

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=S)NCC1=CN=CC=C1

Isomeric SMILES

CCCCCCNC(=S)NCC1=CN=CC=C1

InChI

InChI=1S/C13H21N3S/c1-2-3-4-5-9-15-13(17)16-11-12-7-6-8-14-10-12/h6-8,10H,2-5,9,11H2,1H3,(H2,15,16,17)