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

Systemtic Name: 1-phenyl-3-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-phenyl-3-(3-pyridylmethyl)thiourea CAS Name: 1-phenyl-3-(3-pyridinylmethyl)thiourea IUPAC Name: 1-phenyl-3-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-phenyl-3-(3-pyridylmethyl)thiourea Formula: C13H13N3S MolecularWeight: 243.32742

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)NC(=S)NCC2=CN=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)NC(=S)NCC2=CN=CC=C2

InChI

InChI=1S/C13H13N3S/c17-13(16-12-6-2-1-3-7-12)15-10-11-5-4-8-14-9-11/h1-9H,10H2,(H2,15,16,17)