ethyl 2-[[5-(1,3-benzothiazol-6-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate

Systemtic Name: ethyl 2-[[5-(1,3-benzothiazol-6-ylcarbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]ethanoate Openeye Name: ethyl 2-[[5-(1,3-benzothiazole-6-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate CAS Name: 2-[[5-[[1,3-benzothiazol-6-yl(oxo)methyl]amino]-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester IUPAC Name: ethyl 2-[[5-(1,3-benzothiazole-6-carbonylamino)-1,3,4-thiadiazol-2-yl]sulfanyl]acetate Traditional Name: 2-[[5-(1,3-benzothiazole-6-carbonylamino)-1,3,4-thiadiazol-2-yl]thio]acetic acid ethyl ester Formula: C14H12N4O3S3 MolecularWeight: 380.46508

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3

Isomeric SMILES

CCOC(=O)CSC1=NN=C(S1)NC(=O)C2=CC3=C(C=C2)N=CS3

InChI

InChI=1S/C14H12N4O3S3/c1-2-21-11(19)6-22-14-18-17-13(24-14)16-12(20)8-3-4-9-10(5-8)23-7-15-9/h3-5,7H,2,6H2,1H3,(H,16,17,20)