N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyrazol-1-ylethyl)benzamide

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3,4,5-trimethoxy-N-(2-pyrazol-1-ylethyl)benzamide Formula: C22H22N4O4S MolecularWeight: 438.49948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C22H22N4O4S/c1-28-17-13-15(14-18(29-2)20(17)30-3)21(27)26(12-11-25-10-6-9-23-25)22-24-16-7-4-5-8-19(16)31-22/h4-10,13-14H,11-12H2,1-3H3