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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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