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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3-ethylsulfanyl-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3-ethylsulfanyl-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3-(ethylthio)-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3-ethylsulfanyl-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3-(ethylthio)-N-(2-pyrazol-1-ylethyl)benzamide Formula: C21H20N4OS2 MolecularWeight: 408.5397

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H20N4OS2/c1-2-27-17-8-5-7-16(15-17)20(26)25(14-13-24-12-6-11-22-24)21-23-18-9-3-4-10-19(18)28-21/h3-12,15H,2,13-14H2,1H3