3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide

Systemtic Name: 3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-propyl-benzamide Openeye Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-propyl-benzamide CAS Name: 3-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-propylbenzamide IUPAC Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-propylbenzamide Traditional Name: 3-[(3-butoxybenzoyl)thiocarbamoylamino]-N-propyl-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCCC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCCC

InChI

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