N-butan-2-yl-3-[(3-propoxyphenyl)carbonylcarbamothioylamino]benzamide

Systemtic Name: N-butan-2-yl-3-[(3-propoxyphenyl)carbonylcarbamothioylamino]benzamide Openeye Name: 3-[(3-propoxybenzoyl)carbamothioylamino]-N-sec-butyl-benzamide CAS Name: N-butan-2-yl-3-[[[[oxo-(3-propoxyphenyl)methyl]amino]-sulfanylidenemethyl]amino]benzamide IUPAC Name: N-butan-2-yl-3-[(3-propoxybenzoyl)carbamothioylamino]benzamide Traditional Name: 3-[(3-propoxybenzoyl)thiocarbamoylamino]-N-sec-butyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)CC

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC(C)CC

InChI

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