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N-[(4-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

N-[(4-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name:N-[(4-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine
Openeye Name:N-[(4-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine
CAS Name:N-[(4-chlorophenyl)methyl]-5-nitro-6-(phenylthio)-4-pyrimidinamine
IUPAC Name:N-[(4-chlorophenyl)methyl]-5-nitro-6-phenylsulfanylpyrimidin-4-amine
Traditional Name:(4-chlorobenzyl)-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine
Formula: C17H13ClN4O2S
MolecularWeight: 372.82872
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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl


Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=C(C=C3)Cl


InChI

InChI=1S/C17H13ClN4O2S/c18-13-8-6-12(7-9-13)10-19-16-15(22(23)24)17(21-11-20-16)25-14-4-2-1-3-5-14/h1-9,11H,10H2,(H,19,20,21)


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