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

Systemtic Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazole-4-carboxamide Openeye Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(4-pyridylmethyl)thiazole-4-carboxamide CAS Name: 2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(pyridin-4-ylmethyl)-4-thiazolecarboxamide IUPAC Name: 2-[(5-methyl-1,3-benzoxazol-2-yl)sulfanylmethyl]-N-(pyridin-4-ylmethyl)-1,3-thiazole-4-carboxamide Traditional Name: 2-[[(5-methyl-1,3-benzoxazol-2-yl)thio]methyl]-N-(4-pyridylmethyl)thiazole-4-carboxamide Formula: C19H16N4O2S2 MolecularWeight: 396.48594

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NCC4=CC=NC=C4

Isomeric SMILES

CC1=CC2=C(C=C1)OC(=N2)SCC3=NC(=CS3)C(=O)NCC4=CC=NC=C4

InChI

InChI=1S/C19H16N4O2S2/c1-12-2-3-16-14(8-12)23-19(25-16)27-11-17-22-15(10-26-17)18(24)21-9-13-4-6-20-7-5-13/h2-8,10H,9,11H2,1H3,(H,21,24)