N-[[4-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-propoxy-benzamide

Systemtic Name: N-[[4-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-propoxy-benzamide Openeye Name: N-[[4-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-propoxy-benzamide CAS Name: N-[[4-[(tert-butylamino)-oxomethyl]anilino]-sulfanylidenemethyl]-3-propoxybenzamide IUPAC Name: N-[[4-(tert-butylcarbamoyl)phenyl]carbamothioyl]-3-propoxybenzamide Traditional Name: N-[[4-(tert-butylcarbamoyl)phenyl]thiocarbamoyl]-3-propoxy-benzamide Formula: C22H27N3O3S MolecularWeight: 413.53308

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC(C)(C)C

Isomeric SMILES

CCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)C(=O)NC(C)(C)C

InChI

InChI=1S/C22H27N3O3S/c1-5-13-28-18-8-6-7-16(14-18)19(26)24-21(29)23-17-11-9-15(10-12-17)20(27)25-22(2,3)4/h6-12,14H,5,13H2,1-4H3,(H,25,27)(H2,23,24,26,29)