7-chloranyl-5-pyrimidin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione

Systemtic Name: 7-chloranyl-5-pyrimidin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Openeye Name: 7-chloro-5-pyrimidin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione CAS Name: 7-chloro-5-(2-pyrimidinyl)-1,3-dihydro-1,4-benzodiazepine-2-thione IUPAC Name: 7-chloro-5-pyrimidin-2-yl-1,3-dihydro-1,4-benzodiazepine-2-thione Traditional Name: 7-chloro-5-(2-pyrimidyl)-1,3-dihydro-1,4-benzodiazepine-2-thione Formula: C13H9ClN4S MolecularWeight: 288.75536

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Descriptors Computed from Structure

Canonical SMILES:

C1C(=S)NC2=C(C=C(C=C2)Cl)C(=N1)C3=NC=CC=N3

Isomeric SMILES

C1C(=S)NC2=C(C=C(C=C2)Cl)C(=N1)C3=NC=CC=N3

InChI

InChI=1S/C13H9ClN4S/c14-8-2-3-10-9(6-8)12(17-7-11(19)18-10)13-15-4-1-5-16-13/h1-6H,7H2,(H,18,19)