3,3a,4,6-tetrakis(azanyl)-3,6-dimethyl-2-(sulfanylmethyl)-5H-indene-1,4-diol

Systemtic Name: 3,3a,4,6-tetrakis(azanyl)-3,6-dimethyl-2-(sulfanylmethyl)-5H-indene-1,4-diol Openeye Name: 3,3a,4,6-tetraamino-3,6-dimethyl-2-(sulfanylmethyl)-5H-indene-1,4-diol CAS Name: 3,3a,4,6-tetraamino-2-(mercaptomethyl)-3,6-dimethyl-5H-indene-1,4-diol IUPAC Name: 3,3a,4,6-tetraamino-3,6-dimethyl-2-(sulfanylmethyl)-5H-indene-1,4-diol Traditional Name: 3,3a,4,6-tetraamino-2-(mercaptomethyl)-3,6-dimethyl-5H-indene-1,4-diol Formula: C12H22N4O2S MolecularWeight: 286.39368

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(C2(C(=C1)C(=C(C2(C)N)CS)O)N)(N)O)N

Isomeric SMILES

CC1(CC(C2(C(=C1)C(=C(C2(C)N)CS)O)N)(N)O)N

InChI

InChI=1S/C12H22N4O2S/c1-9(13)3-6-8(17)7(4-19)10(2,14)12(6,16)11(15,18)5-9/h3,17-19H,4-5,13-16H2,1-2H3