2-azanyl-5-nitro-4-(phenylmethylsulfanyl)-1H-pyrimidine-6-thione

Systemtic Name: 2-azanyl-5-nitro-4-(phenylmethylsulfanyl)-1H-pyrimidine-6-thione Openeye Name: 2-amino-4-benzylsulfanyl-5-nitro-1H-pyrimidine-6-thione CAS Name: 2-amino-5-nitro-4-(phenylmethylthio)-1H-pyrimidine-6-thione IUPAC Name: 2-amino-4-benzylsulfanyl-5-nitro-1H-pyrimidine-6-thione Traditional Name: 2-amino-4-(benzylthio)-5-nitro-1H-pyrimidine-6-thione Formula: C11H10N4O2S2 MolecularWeight: 294.3527

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CSC2=C(C(=S)NC(=N2)N)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CSC2=C(C(=S)NC(=N2)N)[N+](=O)[O-]

InChI

InChI=1S/C11H10N4O2S2/c12-11-13-9(18)8(15(16)17)10(14-11)19-6-7-4-2-1-3-5-7/h1-5H,6H2,(H3,12,13,14,18)