N-(2-morpholin-4-ylethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine

Systemtic Name: N-(2-morpholin-4-ylethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine Openeye Name: N-(2-morpholinoethyl)-5-nitro-6-phenylsulfanyl-pyrimidin-4-amine CAS Name: N-[2-(4-morpholinyl)ethyl]-5-nitro-6-(phenylthio)-4-pyrimidinamine IUPAC Name: N-(2-morpholin-4-ylethyl)-5-nitro-6-phenylsulfanylpyrimidin-4-amine Traditional Name: 2-morpholinoethyl-[5-nitro-6-(phenylthio)pyrimidin-4-yl]amine Formula: C16H19N5O3S MolecularWeight: 361.41876

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1CCNC2=C(C(=NC=N2)SC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C16H19N5O3S/c22-21(23)14-15(17-6-7-20-8-10-24-11-9-20)18-12-19-16(14)25-13-4-2-1-3-5-13/h1-5,12H,6-11H2,(H,17,18,19)