2-[(4-chlorophenyl)methylsulfanyl]-N-cyclopropyl-5-nitro-pyrimidin-4-amine

Systemtic Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-cyclopropyl-5-nitro-pyrimidin-4-amine Openeye Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-cyclopropyl-5-nitro-pyrimidin-4-amine CAS Name: 2-[(4-chlorophenyl)methylthio]-N-cyclopropyl-5-nitro-4-pyrimidinamine IUPAC Name: 2-[(4-chlorophenyl)methylsulfanyl]-N-cyclopropyl-5-nitropyrimidin-4-amine Traditional Name: [2-[(4-chlorobenzyl)thio]-5-nitro-pyrimidin-4-yl]-cyclopropyl-amine Formula: C14H13ClN4O2S MolecularWeight: 336.79662

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])SCC3=CC=C(C=C3)Cl

Isomeric SMILES

C1CC1NC2=NC(=NC=C2[N+](=O)[O-])SCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H13ClN4O2S/c15-10-3-1-9(2-4-10)8-22-14-16-7-12(19(20)21)13(18-14)17-11-5-6-11/h1-4,7,11H,5-6,8H2,(H,16,17,18)