6-(naphthalen-1-ylmethylsulfanyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(naphthalen-1-ylmethylsulfanyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(1-naphthylmethylsulfanyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-(1-naphthalenylmethylthio)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(naphthalen-1-ylmethylsulfanyl)-5-nitropyrimidin-4-amine Traditional Name: [6-(1-naphthylmethylthio)-5-nitro-pyrimidin-4-yl]amine Formula: C15H12N4O2S MolecularWeight: 312.34638

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC=C2CSC3=NC=NC(=C3[N+](=O)[O-])N

Isomeric SMILES

C1=CC=C2C(=C1)C=CC=C2CSC3=NC=NC(=C3[N+](=O)[O-])N

InChI

InChI=1S/C15H12N4O2S/c16-14-13(19(20)21)15(18-9-17-14)22-8-11-6-3-5-10-4-1-2-7-12(10)11/h1-7,9H,8H2,(H2,16,17,18)