1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide

Systemtic Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Openeye Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide CAS Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(2-thiazolyl)-3-pyrrolecarboxamide IUPAC Name: 1-[2-(3,4-dimethoxyphenyl)ethyl]-5-ethyl-2-methyl-4-(1,3-thiazol-2-yl)pyrrole-3-carboxamide Traditional Name: 5-ethyl-1-homoveratryl-2-methyl-4-thiazol-2-yl-pyrrole-3-carboxamide Formula: C21H25N3O3S MolecularWeight: 399.5065

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=NC=CS3

Isomeric SMILES

CCC1=C(C(=C(N1CCC2=CC(=C(C=C2)OC)OC)C)C(=O)N)C3=NC=CS3

InChI

InChI=1S/C21H25N3O3S/c1-5-15-19(21-23-9-11-28-21)18(20(22)25)13(2)24(15)10-8-14-6-7-16(26-3)17(12-14)27-4/h6-7,9,11-12H,5,8,10H2,1-4H3,(H2,22,25)