N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-butoxy-3-methoxy-benzamide

Systemtic Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-butoxy-3-methoxy-benzamide Openeye Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-butoxy-3-methoxy-benzamide CAS Name: N-[4-(4-bromophenyl)-5-methyl-2-thiazolyl]-4-butoxy-3-methoxybenzamide IUPAC Name: N-[4-(4-bromophenyl)-5-methyl-1,3-thiazol-2-yl]-4-butoxy-3-methoxybenzamide Traditional Name: N-[4-(4-bromophenyl)-5-methyl-thiazol-2-yl]-4-butoxy-3-methoxy-benzamide Formula: C22H23BrN2O3S MolecularWeight: 475.39862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C)C3=CC=C(C=C3)Br)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(=O)NC2=NC(=C(S2)C)C3=CC=C(C=C3)Br)OC

InChI

InChI=1S/C22H23BrN2O3S/c1-4-5-12-28-18-11-8-16(13-19(18)27-3)21(26)25-22-24-20(14(2)29-22)15-6-9-17(23)10-7-15/h6-11,13H,4-5,12H2,1-3H3,(H,24,25,26)