3-(4-ethylphenyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide

Systemtic Name: 3-(4-ethylphenyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide Openeye Name: 3-(4-ethylphenyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide CAS Name: 3-(4-ethylphenyl)-N-[2-[(2-methyl-1-oxopropyl)amino]-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide IUPAC Name: 3-(4-ethylphenyl)-N-[2-(2-methylpropanoylamino)-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide Traditional Name: 3-(4-ethylphenyl)-N-[2-(isobutyrylamino)-1,3-benzothiazol-5-yl]-1H-pyrazole-5-carboxamide Formula: C23H23N5O2S MolecularWeight: 433.52602

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)NC(=O)C(C)C

Isomeric SMILES

CCC1=CC=C(C=C1)C2=NNC(=C2)C(=O)NC3=CC4=C(C=C3)SC(=N4)NC(=O)C(C)C

InChI

InChI=1S/C23H23N5O2S/c1-4-14-5-7-15(8-6-14)17-12-19(28-27-17)22(30)24-16-9-10-20-18(11-16)25-23(31-20)26-21(29)13(2)3/h5-13H,4H2,1-3H3,(H,24,30)(H,27,28)(H,25,26,29)