2-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(4-ethoxyphenyl)benzamide

Systemtic Name: 2-[(3-butoxyphenyl)carbonylcarbamothioylamino]-N-(4-ethoxyphenyl)benzamide Openeye Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-(4-ethoxyphenyl)benzamide CAS Name: 2-[[[[(3-butoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(4-ethoxyphenyl)benzamide IUPAC Name: 2-[(3-butoxybenzoyl)carbamothioylamino]-N-(4-ethoxyphenyl)benzamide Traditional Name: 2-[(3-butoxybenzoyl)thiocarbamoylamino]-N-p-phenetyl-benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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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=C(C=C3)OCC

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O4S/c1-3-5-17-34-22-10-8-9-19(18-22)25(31)30-27(35)29-24-12-7-6-11-23(24)26(32)28-20-13-15-21(16-14-20)33-4-2/h6-16,18H,3-5,17H2,1-2H3,(H,28,32)(H2,29,30,31,35)