N-hexyl-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide

Systemtic Name: N-hexyl-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Openeye Name: N-hexyl-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]thiazole-4-carboxamide CAS Name: N-hexyl-2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-4-thiazolecarboxamide IUPAC Name: N-hexyl-2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-1,3-thiazole-4-carboxamide Traditional Name: N-hexyl-2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]thiazole-4-carboxamide Formula: C19H23N3O2S2 MolecularWeight: 389.53482

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCNC(=O)C1=CSC(=N1)CSC2=NC3=C(O2)C=CC(=C3)C

Isomeric SMILES

CCCCCCNC(=O)C1=CSC(=N1)CSC2=NC3=C(O2)C=CC(=C3)C

InChI

InChI=1S/C19H23N3O2S2/c1-3-4-5-6-9-20-18(23)15-11-25-17(21-15)12-26-19-22-14-10-13(2)7-8-16(14)24-19/h7-8,10-11H,3-6,9,12H2,1-2H3,(H,20,23)