(2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-(quinolin-8-ylamino)ethyl]sulfanyl-propanamide

Systemtic Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxidanylidene-2-(quinolin-8-ylamino)ethyl]sulfanyl-propanamide Openeye Name: (2S)-N-(5-methylisoxazol-3-yl)-2-[2-oxo-2-(8-quinolylamino)ethyl]sulfanyl-propanamide CAS Name: (2S)-N-(5-methyl-3-isoxazolyl)-2-[[2-oxo-2-(8-quinolinylamino)ethyl]thio]propanamide IUPAC Name: (2S)-N-(5-methyl-1,2-oxazol-3-yl)-2-[2-oxo-2-(quinolin-8-ylamino)ethyl]sulfanylpropanamide Traditional Name: (2S)-2-[[2-keto-2-(8-quinolylamino)ethyl]thio]-N-(5-methylisoxazol-3-yl)propionamide Formula: C18H18N4O3S MolecularWeight: 370.42552

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C)SCC(=O)NC2=CC=CC3=C2N=CC=C3

Isomeric SMILES

CC1=CC(=NO1)NC(=O)[C@H](C)SCC(=O)NC2=CC=CC3=C2N=CC=C3

InChI

InChI=1S/C18H18N4O3S/c1-11-9-15(22-25-11)21-18(24)12(2)26-10-16(23)20-14-7-3-5-13-6-4-8-19-17(13)14/h3-9,12H,10H2,1-2H3,(H,20,23)(H,21,22,24)/t12-/m0/s1