4-[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanoylamino]benzamide

Systemtic Name: 4-[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]ethanoylamino]benzamide Openeye Name: 4-[[2-[2-(3-pyridylmethylcarbamoylamino)thiazol-4-yl]acetyl]amino]benzamide CAS Name: 4-[[1-oxo-2-[2-[[oxo-(3-pyridinylmethylamino)methyl]amino]-4-thiazolyl]ethyl]amino]benzamide IUPAC Name: 4-[[2-[2-(pyridin-3-ylmethylcarbamoylamino)-1,3-thiazol-4-yl]acetyl]amino]benzamide Traditional Name: 4-[[2-[2-(3-pyridylmethylcarbamoylamino)thiazol-4-yl]acetyl]amino]benzamide Formula: C19H18N6O3S MolecularWeight: 410.44962

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CN=C1)CNC(=O)NC2=NC(=CS2)CC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

C1=CC(=CN=C1)CNC(=O)NC2=NC(=CS2)CC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C19H18N6O3S/c20-17(27)13-3-5-14(6-4-13)23-16(26)8-15-11-29-19(24-15)25-18(28)22-10-12-2-1-7-21-9-12/h1-7,9,11H,8,10H2,(H2,20,27)(H,23,26)(H2,22,24,25,28)