N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide Openeye Name: N-[4-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-1-phenyl-ethyl]sulfanylphenyl]cyclopropanecarboxamide CAS Name: N-[4-[[2-[(5-methyl-3-isoxazolyl)amino]-2-oxo-1-phenylethyl]thio]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxo-1-phenylethyl]sulfanylphenyl]cyclopropanecarboxamide Traditional Name: N-[4-[[2-keto-2-[(5-methylisoxazol-3-yl)amino]-1-phenyl-ethyl]thio]phenyl]cyclopropanecarboxamide Formula: C22H21N3O3S MolecularWeight: 407.48544

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4CC4

Isomeric SMILES

CC1=CC(=NO1)NC(=O)C(C2=CC=CC=C2)SC3=CC=C(C=C3)NC(=O)C4CC4

InChI

InChI=1S/C22H21N3O3S/c1-14-13-19(25-28-14)24-22(27)20(15-5-3-2-4-6-15)29-18-11-9-17(10-12-18)23-21(26)16-7-8-16/h2-6,9-13,16,20H,7-8H2,1H3,(H,23,26)(H,24,25,27)