N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-4-(dibutylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide Formula: C27H33N5O3S2 MolecularWeight: 539.71262

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCCCN(CCCC)S(=O)(=O)C1=CC=C(C=C1)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C27H33N5O3S2/c1-3-5-18-31(19-6-4-2)37(34,35)23-14-12-22(13-15-23)26(33)32(21-20-30-17-9-16-28-30)27-29-24-10-7-8-11-25(24)36-27/h7-17H,3-6,18-21H2,1-2H3