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

Systemtic Name: 2-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: 2-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-phenylbenzamide Traditional Name: 2-[(3-butoxybenzoyl)thiocarbamoylamino]-N-phenyl-benzamide Formula: C25H25N3O3S MolecularWeight: 447.5493

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C25H25N3O3S/c1-2-3-16-31-20-13-9-10-18(17-20)23(29)28-25(32)27-22-15-8-7-14-21(22)24(30)26-19-11-5-4-6-12-19/h4-15,17H,2-3,16H2,1H3,(H,26,30)(H2,27,28,29,32)