N-(4-butylphenyl)-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanamide

Systemtic Name: N-(4-butylphenyl)-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanamide Openeye Name: N-(4-butylphenyl)-2-[2-(4-pyridylmethylcarbamoylamino)thiazol-4-yl]acetamide CAS Name: N-(4-butylphenyl)-2-[2-[[oxo-(pyridin-4-ylmethylamino)methyl]amino]-4-thiazolyl]acetamide IUPAC Name: N-(4-butylphenyl)-2-[2-(pyridin-4-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]acetamide Traditional Name: N-(4-butylphenyl)-2-[2-(4-pyridylmethylcarbamoylamino)thiazol-4-yl]acetamide Formula: C22H25N5O2S MolecularWeight: 423.5312

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)NCC3=CC=NC=C3

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)CC2=CSC(=N2)NC(=O)NCC3=CC=NC=C3

InChI

InChI=1S/C22H25N5O2S/c1-2-3-4-16-5-7-18(8-6-16)25-20(28)13-19-15-30-22(26-19)27-21(29)24-14-17-9-11-23-12-10-17/h5-12,15H,2-4,13-14H2,1H3,(H,25,28)(H2,24,26,27,29)