5-nitro-N-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]-6-thiomorpholin-4-yl-pyrimidin-4-amine

Systemtic Name: 5-nitro-N-[[4-(1,2,3-thiadiazol-4-yl)phenyl]methyl]-6-thiomorpholin-4-yl-pyrimidin-4-amine Openeye Name: 5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]-6-thiomorpholino-pyrimidin-4-amine CAS Name: 5-nitro-N-[[4-(4-thiadiazolyl)phenyl]methyl]-6-thiomorpholin-4-yl-4-pyrimidinamine IUPAC Name: 5-nitro-N-[[4-(thiadiazol-4-yl)phenyl]methyl]-6-thiomorpholin-4-ylpyrimidin-4-amine Traditional Name: (5-nitro-6-thiomorpholino-pyrimidin-4-yl)-[4-(thiadiazol-4-yl)benzyl]amine Formula: C17H17N7O2S2 MolecularWeight: 415.49258

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=C(C(=NC=N2)NCC3=CC=C(C=C3)C4=CSN=N4)[N+](=O)[O-]

Isomeric SMILES

C1CSCCN1C2=C(C(=NC=N2)NCC3=CC=C(C=C3)C4=CSN=N4)[N+](=O)[O-]

InChI

InChI=1S/C17H17N7O2S2/c25-24(26)15-16(19-11-20-17(15)23-5-7-27-8-6-23)18-9-12-1-3-13(4-2-12)14-10-28-22-21-14/h1-4,10-11H,5-9H2,(H,18,19,20)