N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-ethylsulfanyl-1,3-benzothiazol-6-amine

Systemtic Name: N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-ethylsulfanyl-1,3-benzothiazol-6-amine Openeye Name: N-(4,6-dimorpholino-1,3,5-triazin-2-yl)-2-ethylsulfanyl-1,3-benzothiazol-6-amine CAS Name: N-[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]-2-(ethylthio)-1,3-benzothiazol-6-amine IUPAC Name: N-(4,6-dimorpholin-4-yl-1,3,5-triazin-2-yl)-2-ethylsulfanyl-1,3-benzothiazol-6-amine Traditional Name: (4,6-dimorpholino-s-triazin-2-yl)-[2-(ethylthio)-1,3-benzothiazol-6-yl]amine Formula: C20H25N7O2S2 MolecularWeight: 459.5882

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NC2=C(S1)C=C(C=C2)NC3=NC(=NC(=N3)N4CCOCC4)N5CCOCC5

Isomeric SMILES

CCSC1=NC2=C(S1)C=C(C=C2)NC3=NC(=NC(=N3)N4CCOCC4)N5CCOCC5

InChI

InChI=1S/C20H25N7O2S2/c1-2-30-20-22-15-4-3-14(13-16(15)31-20)21-17-23-18(26-5-9-28-10-6-26)25-19(24-17)27-7-11-29-12-8-27/h3-4,13H,2,5-12H2,1H3,(H,21,23,24,25)