N-(4-methyl-1,3-thiazol-2-yl)-2-[4-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide

Systemtic Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[4-(2-phenylethanoylamino)phenyl]sulfanyl-propanamide Openeye Name: N-(4-methylthiazol-2-yl)-2-[4-[(2-phenylacetyl)amino]phenyl]sulfanyl-propanamide CAS Name: N-(4-methyl-2-thiazolyl)-2-[[4-[(1-oxo-2-phenylethyl)amino]phenyl]thio]propanamide IUPAC Name: N-(4-methyl-1,3-thiazol-2-yl)-2-[4-[(2-phenylacetyl)amino]phenyl]sulfanylpropanamide Traditional Name: N-(4-methylthiazol-2-yl)-2-[[4-[(2-phenylacetyl)amino]phenyl]thio]propionamide Formula: C21H21N3O2S2 MolecularWeight: 411.54034

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CSC(=N1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3

Isomeric SMILES

CC1=CSC(=N1)NC(=O)C(C)SC2=CC=C(C=C2)NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H21N3O2S2/c1-14-13-27-21(22-14)24-20(26)15(2)28-18-10-8-17(9-11-18)23-19(25)12-16-6-4-3-5-7-16/h3-11,13,15H,12H2,1-2H3,(H,23,25)(H,22,24,26)