methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate

Systemtic Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Openeye Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methyl-thiazole-5-carboxylate CAS Name: 2-[[(E)-3-(4-tert-butylphenyl)-1-oxoprop-2-enyl]amino]-4-methyl-5-thiazolecarboxylic acid methyl ester IUPAC Name: methyl 2-[[(E)-3-(4-tert-butylphenyl)prop-2-enoyl]amino]-4-methyl-1,3-thiazole-5-carboxylate Traditional Name: 2-[[(E)-3-(4-tert-butylphenyl)acryloyl]amino]-4-methyl-thiazole-5-carboxylic acid methyl ester Formula: C19H22N2O3S MolecularWeight: 358.45458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)NC(=O)C=CC2=CC=C(C=C2)C(C)(C)C)C(=O)OC

Isomeric SMILES

CC1=C(SC(=N1)NC(=O)/C=C/C2=CC=C(C=C2)C(C)(C)C)C(=O)OC

InChI

InChI=1S/C19H22N2O3S/c1-12-16(17(23)24-5)25-18(20-12)21-15(22)11-8-13-6-9-14(10-7-13)19(2,3)4/h6-11H,1-5H3,(H,20,21,22)/b11-8+