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

Systemtic Name: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxy-N-(2-pyrazol-1-ylethyl)benzamide Openeye Name: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxy-N-(2-pyrazol-1-ylethyl)benzamide CAS Name: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxy-N-[2-(1-pyrazolyl)ethyl]benzamide IUPAC Name: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxy-N-(2-pyrazol-1-ylethyl)benzamide Traditional Name: N-(1,3-benzothiazol-2-yl)-3,4,5-triethoxy-N-(2-pyrazol-1-ylethyl)benzamide Formula: C25H28N4O4S MolecularWeight: 480.57922

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)N(CCN2C=CC=N2)C3=NC4=CC=CC=C4S3

InChI

InChI=1S/C25H28N4O4S/c1-4-31-20-16-18(17-21(32-5-2)23(20)33-6-3)24(30)29(15-14-28-13-9-12-26-28)25-27-19-10-7-8-11-22(19)34-25/h7-13,16-17H,4-6,14-15H2,1-3H3