1-methyl-3-(pyridin-4-ylmethyl)thiourea

Systemtic Name: 1-methyl-3-(pyridin-4-ylmethyl)thiourea Openeye Name: 1-methyl-3-(4-pyridylmethyl)thiourea CAS Name: 1-methyl-3-(pyridin-4-ylmethyl)thiourea IUPAC Name: 1-methyl-3-(pyridin-4-ylmethyl)thiourea Traditional Name: 1-methyl-3-(4-pyridylmethyl)thiourea Formula: C8H11N3S MolecularWeight: 181.25804

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CNC(=S)NCC1=CC=NC=C1

Isomeric SMILES

CNC(=S)NCC1=CC=NC=C1

InChI

InChI=1S/C8H11N3S/c1-9-8(12)11-6-7-2-4-10-5-3-7/h2-5H,6H2,1H3,(H2,9,11,12)