3-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-(3-methylphenyl)benzamide

Systemtic Name: 3-[(3-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-(3-methylphenyl)benzamide Openeye Name: N-(m-tolyl)-3-[(3-sec-butoxybenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[(3-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(3-methylphenyl)benzamide IUPAC Name: 3-[(3-butan-2-yloxybenzoyl)carbamothioylamino]-N-(3-methylphenyl)benzamide Traditional Name: N-(m-tolyl)-3-[(3-sec-butoxybenzoyl)thiocarbamoylamino]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

Isomeric SMILES

CCC(C)OC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NC3=CC=CC(=C3)C

InChI

InChI=1S/C26H27N3O3S/c1-4-18(3)32-23-13-7-10-20(16-23)25(31)29-26(33)28-22-12-6-9-19(15-22)24(30)27-21-11-5-8-17(2)14-21/h5-16,18H,4H2,1-3H3,(H,27,30)(H2,28,29,31,33)