4-[2-(2-phenylbutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-(2-phenylbutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-(2-phenylbutanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[(1-oxo-2-phenylbutyl)amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-(2-phenylbutanoylamino)-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-(2-phenylbutanoylamino)thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C18H18N4O2S MolecularWeight: 354.42612

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H18N4O2S/c1-2-13(11-6-4-3-5-7-11)17(24)22-18-21-15(10-25-18)12-8-14(16(19)23)20-9-12/h3-10,13,20H,2H2,1H3,(H2,19,23)(H,21,22,24)