2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide

Systemtic Name: 2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-(1-phenylethyl)benzamide Openeye Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide CAS Name: 2-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-(1-phenylethyl)benzamide IUPAC Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-(1-phenylethyl)benzamide Traditional Name: 2-[(4-hexoxybenzoyl)thiocarbamoylamino]-N-(1-phenylethyl)benzamide Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC(C)C3=CC=CC=C3

InChI

InChI=1S/C29H33N3O3S/c1-3-4-5-11-20-35-24-18-16-23(17-19-24)27(33)32-29(36)31-26-15-10-9-14-25(26)28(34)30-21(2)22-12-7-6-8-13-22/h6-10,12-19,21H,3-5,11,20H2,1-2H3,(H,30,34)(H2,31,32,33,36)