4-methyl-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-2-(phenylmethyl)-1,3-thiazole-5-carboxamide

Systemtic Name: 4-methyl-N-[3-oxidanylidene-3-(pyridin-2-ylamino)propyl]-2-(phenylmethyl)-1,3-thiazole-5-carboxamide Openeye Name: 2-benzyl-4-methyl-N-[3-oxo-3-(2-pyridylamino)propyl]thiazole-5-carboxamide CAS Name: 4-methyl-N-[3-oxo-3-(2-pyridinylamino)propyl]-2-(phenylmethyl)-5-thiazolecarboxamide IUPAC Name: 2-benzyl-4-methyl-N-[3-oxo-3-(pyridin-2-ylamino)propyl]-1,3-thiazole-5-carboxamide Traditional Name: 2-benzyl-N-[3-keto-3-(2-pyridylamino)propyl]-4-methyl-thiazole-5-carboxamide Formula: C20H20N4O2S MolecularWeight: 380.4634

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NCCC(=O)NC3=CC=CC=N3

Isomeric SMILES

CC1=C(SC(=N1)CC2=CC=CC=C2)C(=O)NCCC(=O)NC3=CC=CC=N3

InChI

InChI=1S/C20H20N4O2S/c1-14-19(27-18(23-14)13-15-7-3-2-4-8-15)20(26)22-12-10-17(25)24-16-9-5-6-11-21-16/h2-9,11H,10,12-13H2,1H3,(H,22,26)(H,21,24,25)