S-(1,3-benzothiazol-2-yl) (2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-cyclopentyloxyimino-ethanethioate

Systemtic Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-azanyl-1,3-thiazol-4-yl)-2-cyclopentyloxyimino-ethanethioate Openeye Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-aminothiazol-4-yl)-2-(cyclopentoxyimino)ethanethioate CAS Name: (2E)-2-(2-amino-4-thiazolyl)-2-cyclopentyloxyiminoethanethioic acid S-(1,3-benzothiazol-2-yl) ester IUPAC Name: S-(1,3-benzothiazol-2-yl) (2E)-2-(2-amino-1,3-thiazol-4-yl)-2-cyclopentyloxyiminoethanethioate Traditional Name: (2E)-2-(2-aminothiazol-4-yl)-2-cyclopentyloximino-ethanethioic acid S-(1,3-benzothiazol-2-yl) ester Formula: C17H16N4O2S3 MolecularWeight: 404.52954

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)ON=C(C2=CSC(=N2)N)C(=O)SC3=NC4=CC=CC=C4S3

Isomeric SMILES

C1CCC(C1)O/N=C(\C2=CSC(=N2)N)/C(=O)SC3=NC4=CC=CC=C4S3

InChI

InChI=1S/C17H16N4O2S3/c18-16-19-12(9-24-16)14(21-23-10-5-1-2-6-10)15(22)26-17-20-11-7-3-4-8-13(11)25-17/h3-4,7-10H,1-2,5-6H2,(H2,18,19)/b21-14+