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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C=CC(=C1)C2=CSC(=N2)N3C=CC=C3C=O)OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=C(C=CC(=C1)C2=CSC(=N2)N3C=CC=C3C=O)OCC4=CC=CC=C4

InChI

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