2-[4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]butyl]isoindole-1,3-dione

Systemtic Name: 2-[4-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]sulfanyl]butyl]isoindole-1,3-dione Openeye Name: 2-[4-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]butyl]isoindoline-1,3-dione CAS Name: 2-[4-[(4,6-diamino-1,3,5-triazin-2-yl)thio]butyl]isoindole-1,3-dione IUPAC Name: 2-[4-[(4,6-diamino-1,3,5-triazin-2-yl)sulfanyl]butyl]isoindole-1,3-dione Traditional Name: 2-[4-[(4,6-diamino-s-triazin-2-yl)thio]butyl]isoindoline-1,3-quinone Formula: C15H16N6O2S MolecularWeight: 344.39154

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSC3=NC(=NC(=N3)N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCCCSC3=NC(=NC(=N3)N)N

InChI

InChI=1S/C15H16N6O2S/c16-13-18-14(17)20-15(19-13)24-8-4-3-7-21-11(22)9-5-1-2-6-10(9)12(21)23/h1-2,5-6H,3-4,7-8H2,(H4,16,17,18,19,20)