4-(2-bromanyl-4-ethyl-phenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]butanamide

Systemtic Name: 4-(2-bromanyl-4-ethyl-phenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]butanamide Openeye Name: 4-(2-bromo-4-ethyl-phenoxy)-N-[4-(4-phenylphenyl)thiazol-2-yl]butanamide CAS Name: 4-(2-bromo-4-ethylphenoxy)-N-[4-(4-phenylphenyl)-2-thiazolyl]butanamide IUPAC Name: 4-(2-bromo-4-ethylphenoxy)-N-[4-(4-phenylphenyl)-1,3-thiazol-2-yl]butanamide Traditional Name: 4-(2-bromo-4-ethyl-phenoxy)-N-[4-(4-phenylphenyl)thiazol-2-yl]butyramide Formula: C27H25BrN2O2S MolecularWeight: 521.4686

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4)Br

Isomeric SMILES

CCC1=CC(=C(C=C1)OCCCC(=O)NC2=NC(=CS2)C3=CC=C(C=C3)C4=CC=CC=C4)Br

InChI

InChI=1S/C27H25BrN2O2S/c1-2-19-10-15-25(23(28)17-19)32-16-6-9-26(31)30-27-29-24(18-33-27)22-13-11-21(12-14-22)20-7-4-3-5-8-20/h3-5,7-8,10-15,17-18H,2,6,9,16H2,1H3,(H,29,30,31)