N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-pyrazol-1-ylethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-2-ethylsulfonyl-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-2-esyl-N-(2-pyrazol-1-ylethyl)benzamide Formula: C21H20N4O3S2 MolecularWeight: 440.5385

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCS(=O)(=O)C1=CC=CC=C1C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C21H20N4O3S2/c1-2-30(27,28)19-11-6-3-8-16(19)20(26)25(15-14-24-13-7-12-22-24)21-23-17-9-4-5-10-18(17)29-21/h3-13H,2,14-15H2,1H3