4-[(2S)-butan-2-yl]oxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide

Systemtic Name: 4-[(2S)-butan-2-yl]oxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Openeye Name: N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]-4-[(1S)-1-methylpropoxy]benzamide CAS Name: 4-[(2S)-butan-2-yl]oxy-N-[[3-[(2-methyl-1-oxopropyl)amino]anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 4-[(2S)-butan-2-yl]oxy-N-[[3-(2-methylpropanoylamino)phenyl]carbamothioyl]benzamide Traditional Name: N-[[3-(isobutyrylamino)phenyl]thiocarbamoyl]-4-[(1S)-1-methylpropoxy]benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)C

Isomeric SMILES

CC[C@H](C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C(C)C

InChI

InChI=1S/C22H27N3O3S/c1-5-15(4)28-19-11-9-16(10-12-19)21(27)25-22(29)24-18-8-6-7-17(13-18)23-20(26)14(2)3/h6-15H,5H2,1-4H3,(H,23,26)(H2,24,25,27,29)/t15-/m0/s1