3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(2-methoxyethyl)benzamide

Systemtic Name: 3-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(2-methoxyethyl)benzamide Openeye Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-(2-methoxyethyl)benzamide CAS Name: 3-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(2-methoxyethyl)benzamide IUPAC Name: 3-[(3-butoxybenzoyl)carbamothioylamino]-N-(2-methoxyethyl)benzamide Traditional Name: 3-[(3-butoxybenzoyl)thiocarbamoylamino]-N-(2-methoxyethyl)benzamide Formula: C22H27N3O4S MolecularWeight: 429.53248

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H27N3O4S/c1-3-4-12-29-19-10-6-8-17(15-19)21(27)25-22(30)24-18-9-5-7-16(14-18)20(26)23-11-13-28-2/h5-10,14-15H,3-4,11-13H2,1-2H3,(H,23,26)(H2,24,25,27,30)