N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide

Systemtic Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Openeye Name: N-[(4-isopentyloxyphenyl)carbamothioyl]-2-(2-phenoxyethoxy)benzamide CAS Name: N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-2-(2-phenoxyethoxy)benzamide IUPAC Name: N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]-2-(2-phenoxyethoxy)benzamide Traditional Name: N-[(4-isoamoxyphenyl)thiocarbamoyl]-2-(2-phenoxyethoxy)benzamide Formula: C27H30N2O4S MolecularWeight: 478.6031

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCOC3=CC=CC=C3

InChI

InChI=1S/C27H30N2O4S/c1-20(2)16-17-31-23-14-12-21(13-15-23)28-27(34)29-26(30)24-10-6-7-11-25(24)33-19-18-32-22-8-4-3-5-9-22/h3-15,20H,16-19H2,1-2H3,(H2,28,29,30,34)