sodium 2-[6-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl hydrogen sulfate

Systemtic Name: sodium 2-[6-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl hydrogen sulfate Openeye Name: sodium 2-[6-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)azo]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl hydrogen sulfate CAS Name: sodium sulfuric acid 2-[6-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]azo]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl ester IUPAC Name: sodium 2-[6-[(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)diazenyl]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl hydrogen sulfate Traditional Name: sodium sulfuric acid 2-[6-[[5-(ethylthio)-1,3,4-thiadiazol-2-yl]azo]-2,2,4,7-tetramethyl-3,4-dihydroquinolin-1-yl]ethyl ester Formula: C19H27N5NaO4S3+ MolecularWeight: 508.63355

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=NN=C(S1)N=NC2=C(C=C3C(=C2)C(CC(N3CCOS(=O)(=O)O)(C)C)C)C.[Na+]

Isomeric SMILES

CCSC1=NN=C(S1)N=NC2=C(C=C3C(=C2)C(CC(N3CCOS(=O)(=O)O)(C)C)C)C.[Na+]

InChI

InChI=1S/C19H27N5O4S3.Na/c1-6-29-18-23-22-17(30-18)21-20-15-10-14-13(3)11-19(4,5)24(16(14)9-12(15)2)7-8-28-31(25,26)27;/h9-10,13H,6-8,11H2,1-5H3,(H,25,26,27);/q;+1