3-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide

Systemtic Name: 3-[(4-butan-2-yloxyphenyl)carbonylcarbamothioylamino]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-[(4-sec-butoxybenzoyl)carbamothioylamino]benzamide CAS Name: 3-[[[[(4-butan-2-yloxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-[(4-butan-2-yloxybenzoyl)carbamothioylamino]benzamide Traditional Name: N-benzyl-3-[(4-sec-butoxybenzoyl)thiocarbamoylamino]benzamide Formula: C26H27N3O3S MolecularWeight: 461.57588

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCC(C)OC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)NCC3=CC=CC=C3

InChI

InChI=1S/C26H27N3O3S/c1-3-18(2)32-23-14-12-20(13-15-23)25(31)29-26(33)28-22-11-7-10-21(16-22)24(30)27-17-19-8-5-4-6-9-19/h4-16,18H,3,17H2,1-2H3,(H,27,30)(H2,28,29,31,33)