methyl 2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)-5-prop-2-enoxy-pyridine-3-carboxylate

Systemtic Name: methyl 2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)-5-prop-2-enoxy-pyridine-3-carboxylate Openeye Name: methyl 5-allyloxy-2-(4-isopropyl-4-methyl-5-thioxo-1H-imidazol-2-yl)pyridine-3-carboxylate CAS Name: 2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)-5-prop-2-enoxy-3-pyridinecarboxylic acid methyl ester IUPAC Name: methyl 2-(4-methyl-4-propan-2-yl-5-sulfanylidene-1H-imidazol-2-yl)-5-prop-2-enoxypyridine-3-carboxylate Traditional Name: 5-allyloxy-2-(4-isopropyl-4-methyl-5-thioxo-2-imidazolin-2-yl)nicotinic acid methyl ester Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(C(=S)NC(=N1)C2=NC=C(C=C2C(=O)OC)OCC=C)C

Isomeric SMILES

CC(C)C1(C(=S)NC(=N1)C2=NC=C(C=C2C(=O)OC)OCC=C)C

InChI

InChI=1S/C17H21N3O3S/c1-6-7-23-11-8-12(15(21)22-5)13(18-9-11)14-19-16(24)17(4,20-14)10(2)3/h6,8-10H,1,7H2,2-5H3,(H,19,20,24)