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

Systemtic Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(1-phenylethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(1-phenylethyl)thiazole-4-carboxamide CAS Name: 2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(1-phenylethyl)-4-thiazolecarboxamide IUPAC Name: 2-[(4-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(1-phenylethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(4-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(1-phenylethyl)thiazole-4-carboxamide Formula: C21H19N3O2S2 MolecularWeight: 409.52446

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NC(C)C4=CC=CC=C4

Isomeric SMILES

CC1=C2C(=CC=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NC(C)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O2S2/c1-13-7-6-10-17-19(13)24-21(26-17)28-12-18-23-16(11-27-18)20(25)22-14(2)15-8-4-3-5-9-15/h3-11,14H,12H2,1-2H3,(H,22,25)