2-(2-azanylidene-1,3-thiazolidin-3-yl)-5-methoxy-aniline; ethanesulfonic acid

Systemtic Name: 2-(2-azanylidene-1,3-thiazolidin-3-yl)-5-methoxy-aniline; ethanesulfonic acid Openeye Name: ethanesulfonic acid; 2-(2-iminothiazolidin-3-yl)-5-methoxy-aniline CAS Name: ethanesulfonic acid; 2-(2-imino-3-thiazolidinyl)-5-methoxyaniline IUPAC Name: ethanesulfonic acid; 2-(2-imino-1,3-thiazolidin-3-yl)-5-methoxyaniline Traditional Name: esylic acid; [2-(2-iminothiazolidin-3-yl)-5-methoxy-phenyl]amine Formula: C14H25N3O7S3 MolecularWeight: 443.5592

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)O.CCS(=O)(=O)O.COC1=CC(=C(C=C1)N2CCSC2=N)N

Isomeric SMILES

CCS(=O)(=O)O.CCS(=O)(=O)O.COC1=CC(=C(C=C1)N2CCSC2=N)N

InChI

InChI=1S/C10H13N3OS.2C2H6O3S/c1-14-7-2-3-9(8(11)6-7)13-4-5-15-10(13)12;2*1-2-6(3,4)5/h2-3,6,12H,4-5,11H2,1H3;2*2H2,1H3,(H,3,4,5)