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N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide

N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide

Systemtic Name:N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide
Openeye Name:N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide
CAS Name:N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butanamide
IUPAC Name:N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)sulfanyl]butanamide
Traditional Name:N-(2,4-dimethylphenyl)-2-[(6-ethoxy-1,3-benzothiazol-2-yl)thio]butyramide
Formula: C21H24N2O2S2
MolecularWeight: 400.55746
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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=C(C=C(C=C1)C)C)SC2=NC3=C(S2)C=C(C=C3)OCC


Isomeric SMILES

CCC(C(=O)NC1=C(C=C(C=C1)C)C)SC2=NC3=C(S2)C=C(C=C3)OCC


InChI

InChI=1S/C21H24N2O2S2/c1-5-18(20(24)22-16-9-7-13(3)11-14(16)4)26-21-23-17-10-8-15(25-6-2)12-19(17)27-21/h7-12,18H,5-6H2,1-4H3,(H,22,24)


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