2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one

Systemtic Name: 2-[[4,6-bis(azanyl)-1,3,5-triazin-2-yl]methylsulfanyl]-3-(3-oxidanylpropyl)quinazolin-4-one Openeye Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one CAS Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylthio]-3-(3-hydroxypropyl)-4-quinazolinone IUPAC Name: 2-[(4,6-diamino-1,3,5-triazin-2-yl)methylsulfanyl]-3-(3-hydroxypropyl)quinazolin-4-one Traditional Name: 2-[(4,6-diamino-s-triazin-2-yl)methylthio]-3-(3-hydroxypropyl)quinazolin-4-one Formula: C15H17N7O2S MolecularWeight: 359.40618

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NC(=N3)N)N)CCCO

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C(=N2)SCC3=NC(=NC(=N3)N)N)CCCO

InChI

InChI=1S/C15H17N7O2S/c16-13-19-11(20-14(17)21-13)8-25-15-18-10-5-2-1-4-9(10)12(24)22(15)6-3-7-23/h1-2,4-5,23H,3,6-8H2,(H4,16,17,19,20,21)