1-[4-(5-tert-butyl-2-ethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde

Systemtic Name: 1-[4-(5-tert-butyl-2-ethoxy-phenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Openeye Name: 1-[4-(5-tert-butyl-2-ethoxy-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde CAS Name: 1-[4-(5-tert-butyl-2-ethoxyphenyl)-2-thiazolyl]-2-pyrrolecarboxaldehyde IUPAC Name: 1-[4-(5-tert-butyl-2-ethoxyphenyl)-1,3-thiazol-2-yl]pyrrole-2-carbaldehyde Traditional Name: 1-[4-(5-tert-butyl-2-ethoxy-phenyl)thiazol-2-yl]pyrrole-2-carbaldehyde Formula: C20H22N2O2S MolecularWeight: 354.46588

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C=C1)C(C)(C)C)C2=CSC(=N2)N3C=CC=C3C=O

Isomeric SMILES

CCOC1=C(C=C(C=C1)C(C)(C)C)C2=CSC(=N2)N3C=CC=C3C=O

InChI

InChI=1S/C20H22N2O2S/c1-5-24-18-9-8-14(20(2,3)4)11-16(18)17-13-25-19(21-17)22-10-6-7-15(22)12-23/h6-13H,5H2,1-4H3