N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-ethoxy-pyridine-3-carboxamide

Systemtic Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-pyrrol-3-yl)-1,3-thiazol-2-yl]-2-ethoxy-pyridine-3-carboxamide Openeye Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-ethoxy-pyridine-3-carboxamide CAS Name: N-[4-(2,5-dimethyl-1-prop-2-enyl-3-pyrrolyl)-2-thiazolyl]-2-ethoxy-3-pyridinecarboxamide IUPAC Name: N-[4-(2,5-dimethyl-1-prop-2-enylpyrrol-3-yl)-1,3-thiazol-2-yl]-2-ethoxypyridine-3-carboxamide Traditional Name: N-[4-(1-allyl-2,5-dimethyl-pyrrol-3-yl)thiazol-2-yl]-2-ethoxy-nicotinamide Formula: C20H22N4O2S MolecularWeight: 382.47928

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC=N1)C(=O)NC2=NC(=CS2)C3=C(N(C(=C3)C)CC=C)C

Isomeric SMILES

CCOC1=C(C=CC=N1)C(=O)NC2=NC(=CS2)C3=C(N(C(=C3)C)CC=C)C

InChI

InChI=1S/C20H22N4O2S/c1-5-10-24-13(3)11-16(14(24)4)17-12-27-20(22-17)23-18(25)15-8-7-9-21-19(15)26-6-2/h5,7-9,11-12H,1,6,10H2,2-4H3,(H,22,23,25)