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

Systemtic Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-(naphthalen-1-ylcarbamoylamino)propyl]-1,3-thiazole-4-carboxamide Openeye Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-(1-naphthylcarbamoylamino)propyl]thiazole-4-carboxamide CAS Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-[[(1-naphthalenylamino)-oxomethyl]amino]propyl]-4-thiazolecarboxamide IUPAC Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-(naphthalen-1-ylcarbamoylamino)propyl]-1,3-thiazole-4-carboxamide Traditional Name: 2-[(3,5-dimethylphenoxy)methyl]-N-[3-(1-naphthylcarbamoylamino)propyl]thiazole-4-carboxamide Formula: C27H28N4O3S MolecularWeight: 488.60122

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCNC(=O)NC3=CC=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=CC(=CC(=C1)OCC2=NC(=CS2)C(=O)NCCCNC(=O)NC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C27H28N4O3S/c1-18-13-19(2)15-21(14-18)34-16-25-30-24(17-35-25)26(32)28-11-6-12-29-27(33)31-23-10-5-8-20-7-3-4-9-22(20)23/h3-5,7-10,13-15,17H,6,11-12,16H2,1-2H3,(H,28,32)(H2,29,31,33)