N-(3-azanylpropyl)-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-(3-azanylpropyl)-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Openeye Name: N-(3-aminopropyl)-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide CAS Name: N-(3-aminopropyl)-2-[(3,5-dimethylphenoxy)methyl]-4-thiazolecarboxamide IUPAC Name: N-(3-aminopropyl)-2-[(3,5-dimethylphenoxy)methyl]-1,3-thiazole-4-carboxamide Traditional Name: N-(3-aminopropyl)-2-[(3,5-dimethylphenoxy)methyl]thiazole-4-carboxamide Formula: C16H21N3O2S MolecularWeight: 319.42184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCN)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCN)C

InChI

InChI=1S/C16H21N3O2S/c1-11-6-12(2)8-13(7-11)21-9-15-19-14(10-22-15)16(20)18-5-3-4-17/h6-8,10H,3-5,9,17H2,1-2H3,(H,18,20)