N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzamide

Systemtic Name: N-[2-(cyclopropylamino)-2-oxidanylidene-ethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzamide Openeye Name: N-[2-(cyclopropylamino)-2-oxo-ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylsulfanyl]benzamide CAS Name: N-[2-(cyclopropylamino)-2-oxoethyl]-2-[(3,5-dimethyl-4-isoxazolyl)methylthio]benzamide IUPAC Name: N-[2-(cyclopropylamino)-2-oxoethyl]-2-[(3,5-dimethyl-1,2-oxazol-4-yl)methylsulfanyl]benzamide Traditional Name: N-[2-(cyclopropylamino)-2-keto-ethyl]-2-[(3,5-dimethylisoxazol-4-yl)methylthio]benzamide Formula: C18H21N3O3S MolecularWeight: 359.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCC(=O)NC3CC3

Isomeric SMILES

CC1=C(C(=NO1)C)CSC2=CC=CC=C2C(=O)NCC(=O)NC3CC3

InChI

InChI=1S/C18H21N3O3S/c1-11-15(12(2)24-21-11)10-25-16-6-4-3-5-14(16)18(23)19-9-17(22)20-13-7-8-13/h3-6,13H,7-10H2,1-2H3,(H,19,23)(H,20,22)