N-(furan-2-ylmethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(furan-2-ylmethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(2-furylmethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-(2-furanylmethyl)-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(furan-2-ylmethyl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: 2-furfuryl-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C15H12N4O3S MolecularWeight: 328.34578

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CO3

InChI

InChI=1S/C15H12N4O3S/c20-19(21)13-14(16-9-11-5-4-8-22-11)17-10-18-15(13)23-12-6-2-1-3-7-12/h1-8,10H,9H2,(H,16,17,18)