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

Systemtic Name: 1-(phenylmethyl)-3-(pyridin-3-ylmethyl)thiourea Openeye Name: 1-benzyl-3-(3-pyridylmethyl)thiourea CAS Name: 1-(phenylmethyl)-3-(3-pyridinylmethyl)thiourea IUPAC Name: 1-benzyl-3-(pyridin-3-ylmethyl)thiourea Traditional Name: 1-benzyl-3-(3-pyridylmethyl)thiourea Formula: C14H15N3S MolecularWeight: 257.354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H15N3S/c18-14(16-10-12-5-2-1-3-6-12)17-11-13-7-4-8-15-9-13/h1-9H,10-11H2,(H2,16,17,18)