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N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-nitro-1-benzothiophene-2-carboxamide

N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-nitro-1-benzothiophene-2-carboxamide

Systemtic Name:N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-nitro-1-benzothiophene-2-carboxamide
Openeye Name:N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanyl-propyl]-5-nitro-benzothiophene-2-carboxamide
CAS Name:N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-nitro-1-benzothiophene-2-carboxamide
IUPAC Name:N-[1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-5-nitro-1-benzothiophene-2-carboxamide
Traditional Name:N-[1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-5-nitro-benzothiophene-2-carboxamide
Formula: C20H18N4O3S2
MolecularWeight: 426.51192
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Descriptors Computed from Structure

Canonical SMILES:

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]


Isomeric SMILES

CSCCC(C1=NC2=CC=CC=C2N1)NC(=O)C3=CC4=C(S3)C=CC(=C4)[N+](=O)[O-]


InChI

InChI=1S/C20H18N4O3S2/c1-28-9-8-16(19-21-14-4-2-3-5-15(14)22-19)23-20(25)18-11-12-10-13(24(26)27)6-7-17(12)29-18/h2-7,10-11,16H,8-9H2,1H3,(H,21,22)(H,23,25)


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