2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-phenyl-benzamide

Systemtic Name: 2-[(4-hexoxyphenyl)carbonylcarbamothioylamino]-N-phenyl-benzamide Openeye Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-phenyl-benzamide CAS Name: 2-[[[[(4-hexoxyphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]-N-phenylbenzamide IUPAC Name: 2-[(4-hexoxybenzoyl)carbamothioylamino]-N-phenylbenzamide Traditional Name: 2-[(4-hexoxybenzoyl)thiocarbamoylamino]-N-phenyl-benzamide Formula: C27H29N3O3S MolecularWeight: 475.60246

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC=C2C(=O)NC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O3S/c1-2-3-4-10-19-33-22-17-15-20(16-18-22)25(31)30-27(34)29-24-14-9-8-13-23(24)26(32)28-21-11-6-5-7-12-21/h5-9,11-18H,2-4,10,19H2,1H3,(H,28,32)(H2,29,30,31,34)