N5-[1,1-bis(oxidanylidene)thiolan-3-yl]isoquinoline-5,8-diamine

Systemtic Name: N5-[1,1-bis(oxidanylidene)thiolan-3-yl]isoquinoline-5,8-diamine Openeye Name: N5-(1,1-dioxothiolan-3-yl)isoquinoline-5,8-diamine CAS Name: N5-(1,1-dioxo-3-thiolanyl)isoquinoline-5,8-diamine IUPAC Name: 5-N-(1,1-dioxothiolan-3-yl)isoquinoline-5,8-diamine Traditional Name: (8-amino-5-isoquinolyl)-(1,1-diketothiolan-3-yl)amine Formula: C13H15N3O2S MolecularWeight: 277.3421

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Descriptors Computed from Structure

Canonical SMILES:

C1CS(=O)(=O)CC1NC2=C3C=CN=CC3=C(C=C2)N

Isomeric SMILES

C1CS(=O)(=O)CC1NC2=C3C=CN=CC3=C(C=C2)N

InChI

InChI=1S/C13H15N3O2S/c14-12-1-2-13(10-3-5-15-7-11(10)12)16-9-4-6-19(17,18)8-9/h1-3,5,7,9,16H,4,6,8,14H2