N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-propanamide

Systemtic Name: N-[4-(4-acetamido-2-fluoranyl-phenyl)-1,3-thiazol-2-yl]-3-(2-azanyl-2-oxidanylidene-ethyl)sulfanyl-propanamide Openeye Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-(2-amino-2-oxo-ethyl)sulfanyl-propanamide CAS Name: N-[4-(4-acetamido-2-fluorophenyl)-2-thiazolyl]-3-[(2-amino-2-oxoethyl)thio]propanamide IUPAC Name: N-[4-(4-acetamido-2-fluorophenyl)-1,3-thiazol-2-yl]-3-(2-amino-2-oxoethyl)sulfanylpropanamide Traditional Name: N-[4-(4-acetamido-2-fluoro-phenyl)thiazol-2-yl]-3-[(2-amino-2-keto-ethyl)thio]propionamide Formula: C16H17FN4O3S2 MolecularWeight: 396.459583

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCSCC(=O)N)F

Isomeric SMILES

CC(=O)NC1=CC(=C(C=C1)C2=CSC(=N2)NC(=O)CCSCC(=O)N)F

InChI

InChI=1S/C16H17FN4O3S2/c1-9(22)19-10-2-3-11(12(17)6-10)13-7-26-16(20-13)21-15(24)4-5-25-8-14(18)23/h2-3,6-7H,4-5,8H2,1H3,(H2,18,23)(H,19,22)(H,20,21,24)