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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

Isomeric SMILES

CCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCCCO

InChI

InChI=1S/C22H27N3O4S/c1-2-3-15-29-19-12-7-5-10-17(19)21(28)25-22(30)24-18-11-6-4-9-16(18)20(27)23-13-8-14-26/h4-7,9-12,26H,2-3,8,13-15H2,1H3,(H,23,27)(H2,24,25,28,30)