methyl 2-(2-pentanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate

Systemtic Name: methyl 2-(2-pentanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)ethanoate Openeye Name: methyl 2-(2-pentanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate CAS Name: 2-[2-(1-oxopentylimino)-6-sulfamoyl-1,3-benzothiazol-3-yl]acetic acid methyl ester IUPAC Name: methyl 2-(2-pentanoylimino-6-sulfamoyl-1,3-benzothiazol-3-yl)acetate Traditional Name: 2-(6-sulfamoyl-2-valerylimino-1,3-benzothiazol-3-yl)acetic acid methyl ester Formula: C15H19N3O5S2 MolecularWeight: 385.45846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OC

Isomeric SMILES

CCCCC(=O)N=C1N(C2=C(S1)C=C(C=C2)S(=O)(=O)N)CC(=O)OC

InChI

InChI=1S/C15H19N3O5S2/c1-3-4-5-13(19)17-15-18(9-14(20)23-2)11-7-6-10(25(16,21)22)8-12(11)24-15/h6-8H,3-5,9H2,1-2H3,(H2,16,21,22)