4-(3-sulfosulfanylpropylamino)quinazoline

Systemtic Name: 4-(3-sulfosulfanylpropylamino)quinazoline Openeye Name: 4-(3-sulfosulfanylpropylamino)quinazoline CAS Name: 4-[3-(sulfothio)propylamino]quinazoline IUPAC Name: 4-(3-sulfosulfanylpropylamino)quinazoline Traditional Name: 4-[3-(sulfothio)propylamino]quinazoline Formula: C11H13N3O3S2 MolecularWeight: 299.36922

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=NC=N2)NCCCSS(=O)(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=NC=N2)NCCCSS(=O)(=O)O

InChI

InChI=1S/C11H13N3O3S2/c15-19(16,17)18-7-3-6-12-11-9-4-1-2-5-10(9)13-8-14-11/h1-2,4-5,8H,3,6-7H2,(H,12,13,14)(H,15,16,17)