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

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

Systemtic Name:ethyl 3-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoate
Openeye Name:ethyl 3-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoate
CAS Name:3-[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]propanoic acid ethyl ester
IUPAC Name:ethyl 3-[5-[(6-nitro-1,3-benzothiazol-2-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]propanoate
Traditional Name:3-[5-[(6-nitro-1,3-benzothiazol-2-yl)thio]-1,3,4-thiadiazol-2-yl]propionic acid ethyl ester
Formula: C14H12N4O4S3
MolecularWeight: 396.46448
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CCC1=NN=C(S1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


Isomeric SMILES

CCOC(=O)CCC1=NN=C(S1)SC2=NC3=C(S2)C=C(C=C3)[N+](=O)[O-]


InChI

InChI=1S/C14H12N4O4S3/c1-2-22-12(19)6-5-11-16-17-14(24-11)25-13-15-9-4-3-8(18(20)21)7-10(9)23-13/h3-4,7H,2,5-6H2,1H3


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