1-pyridin-2-yl-3-[(E)-1-pyrimidin-4-ylethylideneamino]thiourea

Systemtic Name: 1-pyridin-2-yl-3-[(E)-1-pyrimidin-4-ylethylideneamino]thiourea Openeye Name: 1-(2-pyridyl)-3-[(E)-1-pyrimidin-4-ylethylideneamino]thiourea CAS Name: 1-(2-pyridinyl)-3-[(E)-1-(4-pyrimidinyl)ethylideneamino]thiourea IUPAC Name: 1-pyridin-2-yl-3-[(E)-1-pyrimidin-4-ylethylideneamino]thiourea Traditional Name: 1-(2-pyridyl)-3-[(E)-1-(4-pyrimidyl)ethylideneamino]thiourea Formula: C12H12N6S MolecularWeight: 272.32888

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=S)NC1=CC=CC=N1)C2=NC=NC=C2

Isomeric SMILES

C/C(=N\NC(=S)NC1=CC=CC=N1)/C2=NC=NC=C2

InChI

InChI=1S/C12H12N6S/c1-9(10-5-7-13-8-15-10)17-18-12(19)16-11-4-2-3-6-14-11/h2-8H,1H3,(H2,14,16,18,19)/b17-9+