4-[2-[4-(4-tert-butylphenoxy)butanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide

Systemtic Name: 4-[2-[4-(4-tert-butylphenoxy)butanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Openeye Name: 4-[2-[4-(4-tert-butylphenoxy)butanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide CAS Name: 4-[2-[[4-(4-tert-butylphenoxy)-1-oxobutyl]amino]-4-thiazolyl]-1H-pyrrole-2-carboxamide IUPAC Name: 4-[2-[4-(4-tert-butylphenoxy)butanoylamino]-1,3-thiazol-4-yl]-1H-pyrrole-2-carboxamide Traditional Name: 4-[2-[4-(4-tert-butylphenoxy)butanoylamino]thiazol-4-yl]-1H-pyrrole-2-carboxamide Formula: C22H26N4O3S MolecularWeight: 426.53184

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H26N4O3S/c1-22(2,3)15-6-8-16(9-7-15)29-10-4-5-19(27)26-21-25-18(13-30-21)14-11-17(20(23)28)24-12-14/h6-9,11-13,24H,4-5,10H2,1-3H3,(H2,23,28)(H,25,26,27)