1-[4-(5-butan-2-yl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde

Systemtic Name: 1-[4-(5-butan-2-yl-2-phenylmethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Openeye Name: 1-[4-(2-benzyloxy-5-sec-butyl-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde CAS Name: 1-[4-(5-butan-2-yl-2-phenylmethoxyphenyl)-2-thiazolyl]-2-pyrrolecarboxaldehyde IUPAC Name: 1-[4-(5-butan-2-yl-2-phenylmethoxyphenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Traditional Name: 1-[4-(2-benzoxy-5-sec-butyl-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde Formula: C25H24N2O2S MolecularWeight: 416.53526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC(=N3)N4C=CC=C4C=O

Isomeric SMILES

CCC(C)C1=CC(=C(C=C1)OCC2=CC=CC=C2)C3=CSC(=N3)N4C=CC=C4C=O

InChI

InChI=1S/C25H24N2O2S/c1-3-18(2)20-11-12-24(29-16-19-8-5-4-6-9-19)22(14-20)23-17-30-25(26-23)27-13-7-10-21(27)15-28/h4-15,17-18H,3,16H2,1-2H3