N-[(2-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-[(2-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-[(2-chlorophenyl)methyl]-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-[(2-chlorophenyl)methyl]-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-[(2-chlorophenyl)methyl]-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: (2-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=CC=C3Cl

Isomeric SMILES

C1=CC=C(C=C1)SC2=NC=NC(=C2[N+](=O)[O-])NCC3=CC=CC=C3Cl

InChI

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