4-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzamide

Systemtic Name: 4-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzamide Openeye Name: 4-[3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]propanoylamino]benzamide CAS Name: 4-[[3-[2-[[(4-methoxyanilino)-oxomethyl]amino]-4-thiazolyl]-1-oxopropyl]amino]benzamide IUPAC Name: 4-[3-[2-[(4-methoxyphenyl)carbamoylamino]-1,3-thiazol-4-yl]propanoylamino]benzamide Traditional Name: 4-[3-[2-[(4-methoxyphenyl)carbamoylamino]thiazol-4-yl]propanoylamino]benzamide Formula: C21H21N5O4S MolecularWeight: 439.48754

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC=C(C=C3)C(=O)N

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)NC2=NC(=CS2)CCC(=O)NC3=CC=C(C=C3)C(=O)N

InChI

InChI=1S/C21H21N5O4S/c1-30-17-9-6-15(7-10-17)24-20(29)26-21-25-16(12-31-21)8-11-18(27)23-14-4-2-13(3-5-14)19(22)28/h2-7,9-10,12H,8,11H2,1H3,(H2,22,28)(H,23,27)(H2,24,25,26,29)