3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-sulfanyl-indazol-6-amine

Systemtic Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-sulfanyl-indazol-6-amine Openeye Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-sulfanyl-indazol-6-amine CAS Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-mercapto-6-indazolamine IUPAC Name: 3-[(E)-2-(1,3-benzodioxol-5-yl)ethenyl]-1-sulfanylindazol-6-amine Traditional Name: [3-[(E)-2-(1,3-benzodioxol-5-yl)vinyl]-1-mercapto-indazol-6-yl]amine Formula: C16H13N3O2S MolecularWeight: 311.35832

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=CC3=NN(C4=C3C=CC(=C4)N)S

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C/C3=NN(C4=C3C=CC(=C4)N)S

InChI

InChI=1S/C16H13N3O2S/c17-11-3-4-12-13(18-19(22)14(12)8-11)5-1-10-2-6-15-16(7-10)21-9-20-15/h1-8,22H,9,17H2/b5-1+