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

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NCC3=CC=CC=C3

InChI

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