N-(1,3-benzothiazol-2-yl)-2-(4-ethylsulfanylphenyl)-N-(2-pyrazol-1-ylethyl)ethanamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-(4-ethylsulfanylphenyl)-N-(2-pyrazol-1-ylethyl)ethanamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-(4-ethylsulfanylphenyl)-N-(2-pyrazol-1-ylethyl)acetamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-[4-(ethylthio)phenyl]-N-[2-(1-pyrazolyl)ethyl]acetamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-(4-ethylsulfanylphenyl)-N-(2-pyrazol-1-ylethyl)acetamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-[4-(ethylthio)phenyl]-N-(2-pyrazol-1-ylethyl)acetamide Formula: C22H22N4OS2 MolecularWeight: 422.56628

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=C(C=C1)CC(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCSC1=CC=C(C=C1)CC(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4OS2/c1-2-28-18-10-8-17(9-11-18)16-21(27)26(15-14-25-13-5-12-23-25)22-24-19-6-3-4-7-20(19)29-22/h3-13H,2,14-16H2,1H3