3-acetamido-N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-yl-propanamide

Systemtic Name: 3-acetamido-N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-yl-propanamide Openeye Name: 3-acetamido-N-[4-(4-tert-butylphenyl)thiazol-2-yl]-3-(2-thienyl)propanamide CAS Name: 3-acetamido-N-[4-(4-tert-butylphenyl)-2-thiazolyl]-3-thiophen-2-ylpropanamide IUPAC Name: 3-acetamido-N-[4-(4-tert-butylphenyl)-1,3-thiazol-2-yl]-3-thiophen-2-ylpropanamide Traditional Name: 3-acetamido-N-[4-(4-tert-butylphenyl)thiazol-2-yl]-3-(2-thienyl)propionamide Formula: C22H25N3O2S2 MolecularWeight: 427.5828

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC(CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CS3

Isomeric SMILES

CC(=O)NC(CC(=O)NC1=NC(=CS1)C2=CC=C(C=C2)C(C)(C)C)C3=CC=CS3

InChI

InChI=1S/C22H25N3O2S2/c1-14(26)23-17(19-6-5-11-28-19)12-20(27)25-21-24-18(13-29-21)15-7-9-16(10-8-15)22(2,3)4/h5-11,13,17H,12H2,1-4H3,(H,23,26)(H,24,25,27)