O4-[(E)-[azanyl-(2-azanyl-5-ethylsulfonyl-thiophen-3-yl)methylidene]amino] O1-methyl butanedioate

Systemtic Name: O4-[(E)-[azanyl-(2-azanyl-5-ethylsulfonyl-thiophen-3-yl)methylidene]amino] O1-methyl butanedioate Openeye Name: O4-[(E)-[amino-(2-amino-5-ethylsulfonyl-3-thienyl)methylene]amino] O1-methyl butanedioate CAS Name: butanedioic acid O4-[(E)-[amino-(2-amino-5-ethylsulfonyl-3-thiophenyl)methylidene]amino] ester O1-methyl ester IUPAC Name: 4-O-[(E)-[amino-(2-amino-5-ethylsulfonylthiophen-3-yl)methylidene]amino] 1-O-methyl butanedioate Traditional Name: succinic acid O4-[(E)-[amino-(2-amino-5-esyl-3-thienyl)methylene]amino] ester O1-methyl ester Formula: C12H17N3O6S2 MolecularWeight: 363.40988

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC(=C(S1)N)C(=NOC(=O)CCC(=O)OC)N

Isomeric SMILES

CCS(=O)(=O)C1=CC(=C(S1)N)/C(=N\OC(=O)CCC(=O)OC)/N

InChI

InChI=1S/C12H17N3O6S2/c1-3-23(18,19)10-6-7(12(14)22-10)11(13)15-21-9(17)5-4-8(16)20-2/h6H,3-5,14H2,1-2H3,(H2,13,15)