[(Z)-1-(2-azanylpyridin-4-yl)propylideneamino] 4-methylbenzenesulfonate

Systemtic Name: [(Z)-1-(2-azanylpyridin-4-yl)propylideneamino] 4-methylbenzenesulfonate Openeye Name: [(Z)-1-(2-amino-4-pyridyl)propylideneamino] 4-methylbenzenesulfonate CAS Name: 4-methylbenzenesulfonic acid [(Z)-1-(2-amino-4-pyridinyl)propylideneamino] ester IUPAC Name: [(Z)-1-(2-aminopyridin-4-yl)propylideneamino] 4-methylbenzenesulfonate Traditional Name: 4-methylbenzenesulfonic acid [(Z)-1-(2-amino-4-pyridyl)propylideneamino] ester Formula: C15H17N3O3S MolecularWeight: 319.37878

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NOS(=O)(=O)C1=CC=C(C=C1)C)C2=CC(=NC=C2)N

Isomeric SMILES

CC/C(=N/OS(=O)(=O)C1=CC=C(C=C1)C)/C2=CC(=NC=C2)N

InChI

InChI=1S/C15H17N3O3S/c1-3-14(12-8-9-17-15(16)10-12)18-21-22(19,20)13-6-4-11(2)5-7-13/h4-10H,3H2,1-2H3,(H2,16,17)/b18-14-