6-(4-chlorophenyl)sulfanyl-N,N-bis(2-methoxyethyl)-5-nitro-pyrimidin-4-amine

Systemtic Name: 6-(4-chlorophenyl)sulfanyl-N,N-bis(2-methoxyethyl)-5-nitro-pyrimidin-4-amine Openeye Name: 6-(4-chlorophenyl)sulfanyl-N,N-bis(2-methoxyethyl)-5-nitro-pyrimidin-4-amine CAS Name: 6-[(4-chlorophenyl)thio]-N,N-bis(2-methoxyethyl)-5-nitro-4-pyrimidinamine IUPAC Name: 6-(4-chlorophenyl)sulfanyl-N,N-bis(2-methoxyethyl)-5-nitropyrimidin-4-amine Traditional Name: [6-[(4-chlorophenyl)thio]-5-nitro-pyrimidin-4-yl]-bis(2-methoxyethyl)amine Formula: C16H19ClN4O4S MolecularWeight: 398.86446

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Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

Isomeric SMILES

COCCN(CCOC)C1=C(C(=NC=N1)SC2=CC=C(C=C2)Cl)[N+](=O)[O-]

InChI

InChI=1S/C16H19ClN4O4S/c1-24-9-7-20(8-10-25-2)15-14(21(22)23)16(19-11-18-15)26-13-5-3-12(17)4-6-13/h3-6,11H,7-10H2,1-2H3