N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-butan-2-yloxy-benzamide

Systemtic Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-butan-2-yloxy-benzamide Openeye Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-sec-butoxy-benzamide CAS Name: 3-butan-2-yloxy-N-[[4-(1-oxobutylamino)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: N-[[4-(butanoylamino)phenyl]carbamothioyl]-3-butan-2-yloxybenzamide Traditional Name: N-[(4-butyramidophenyl)thiocarbamoyl]-3-sec-butoxy-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)CC

Isomeric SMILES

CCCC(=O)NC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC(=CC=C2)OC(C)CC

InChI

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