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N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide

Systemtic Name:N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]ethanamide
Openeye Name:N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitro-phenyl)methylsulfanyl]acetamide
CAS Name:N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitrophenyl)methylthio]acetamide
IUPAC Name:N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitrophenyl)methylsulfanyl]acetamide
Traditional Name:N-(6-ethyl-1,3-benzothiazol-2-yl)-2-[(4-methoxy-3-nitro-benzyl)thio]acetamide
Formula: C19H19N3O4S2
MolecularWeight: 417.50186
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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]


Isomeric SMILES

CCC1=CC2=C(C=C1)N=C(S2)NC(=O)CSCC3=CC(=C(C=C3)OC)[N+](=O)[O-]


InChI

InChI=1S/C19H19N3O4S2/c1-3-12-4-6-14-17(9-12)28-19(20-14)21-18(23)11-27-10-13-5-7-16(26-2)15(8-13)22(24)25/h4-9H,3,10-11H2,1-2H3,(H,20,21,23)


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