N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[[3-[(tert-butylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[3-(tert-butylcarbamoyl)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[[3-(tert-butylcarbamoyl)phenyl]thiocarbamoyl]-2-(2-phenoxyethoxy)benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)(C)NC(=O)C1=CC(=CC=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H29N3O4S/c1-27(2,3)30-24(31)19-10-9-11-20(18-19)28-26(35)29-25(32)22-14-7-8-15-23(22)34-17-16-33-21-12-5-4-6-13-21/h4-15,18H,16-17H2,1-3H3,(H,30,31)(H2,28,29,32,35)