2-[(2-ethoxynaphthalen-1-yl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid

Systemtic Name: 2-[(2-ethoxynaphthalen-1-yl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(2-ethoxy-1-naphthyl)methylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(2-ethoxy-1-naphthalenyl)methylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(2-ethoxynaphthalen-1-yl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(2-ethoxy-1-naphthyl)methylamino]-4-methyl-thiazole-5-carboxylic acid Formula: C18H18N2O3S MolecularWeight: 342.41212

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C2=CC=CC=C2C=C1)CNC3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CCOC1=C(C2=CC=CC=C2C=C1)CNC3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C18H18N2O3S/c1-3-23-15-9-8-12-6-4-5-7-13(12)14(15)10-19-18-20-11(2)16(24-18)17(21)22/h4-9H,3,10H2,1-2H3,(H,19,20)(H,21,22)