N-[4-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide

Systemtic Name: N-[4-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxidanylidene-propan-2-yl]sulfanylphenyl]butanamide Openeye Name: N-[4-[1-methyl-2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]sulfanylphenyl]butanamide CAS Name: N-[4-[[1-[(5-methyl-3-isoxazolyl)amino]-1-oxopropan-2-yl]thio]phenyl]butanamide IUPAC Name: N-[4-[1-[(5-methyl-1,2-oxazol-3-yl)amino]-1-oxopropan-2-yl]sulfanylphenyl]butanamide Traditional Name: N-[4-[[2-keto-1-methyl-2-[(5-methylisoxazol-3-yl)amino]ethyl]thio]phenyl]butyramide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)SC(C)C(=O)NC2=NOC(=C2)C

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)SC(C)C(=O)NC2=NOC(=C2)C

InChI

InChI=1S/C17H21N3O3S/c1-4-5-16(21)18-13-6-8-14(9-7-13)24-12(3)17(22)19-15-10-11(2)23-20-15/h6-10,12H,4-5H2,1-3H3,(H,18,21)(H,19,20,22)