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

Systemtic Name: 2-[(2-butoxynaphthalen-1-yl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Openeye Name: 2-[(2-butoxy-1-naphthyl)methylamino]-4-methyl-thiazole-5-carboxylic acid CAS Name: 2-[(2-butoxy-1-naphthalenyl)methylamino]-4-methyl-5-thiazolecarboxylic acid IUPAC Name: 2-[(2-butoxynaphthalen-1-yl)methylamino]-4-methyl-1,3-thiazole-5-carboxylic acid Traditional Name: 2-[(2-butoxy-1-naphthyl)methylamino]-4-methyl-thiazole-5-carboxylic acid Formula: C20H22N2O3S MolecularWeight: 370.46528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C2=CC=CC=C2C=C1)CNC3=NC(=C(S3)C(=O)O)C

Isomeric SMILES

CCCCOC1=C(C2=CC=CC=C2C=C1)CNC3=NC(=C(S3)C(=O)O)C

InChI

InChI=1S/C20H22N2O3S/c1-3-4-11-25-17-10-9-14-7-5-6-8-15(14)16(17)12-21-20-22-13(2)18(26-20)19(23)24/h5-10H,3-4,11-12H2,1-2H3,(H,21,22)(H,23,24)