[2-[(2,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl naphthalene-1-carboxylate

Systemtic Name: [2-[(2,4-dimethylphenyl)-ethanoyl-amino]-1,3-thiazol-4-yl]methyl naphthalene-1-carboxylate Openeye Name: [2-(N-acetyl-2,4-dimethyl-anilino)thiazol-4-yl]methyl naphthalene-1-carboxylate CAS Name: 1-naphthalenecarboxylic acid [2-(N-acetyl-2,4-dimethylanilino)-4-thiazolyl]methyl ester IUPAC Name: [2-(N-acetyl-2,4-dimethylanilino)-1,3-thiazol-4-yl]methyl naphthalene-1-carboxylate Traditional Name: naphthalene-1-carboxylic acid [2-(N-acetyl-2,4-dimethyl-anilino)thiazol-4-yl]methyl ester Formula: C25H22N2O3S MolecularWeight: 430.51878

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC=CC4=CC=CC=C43)C(=O)C)C

Isomeric SMILES

CC1=CC(=C(C=C1)N(C2=NC(=CS2)COC(=O)C3=CC=CC4=CC=CC=C43)C(=O)C)C

InChI

InChI=1S/C25H22N2O3S/c1-16-11-12-23(17(2)13-16)27(18(3)28)25-26-20(15-31-25)14-30-24(29)22-10-6-8-19-7-4-5-9-21(19)22/h4-13,15H,14H2,1-3H3