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

Systemtic Name: 3-butoxy-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Openeye Name: 3-butoxy-N-[(4-isopentyloxyphenyl)carbamothioyl]benzamide CAS Name: 3-butoxy-N-[[4-(3-methylbutoxy)anilino]-sulfanylidenemethyl]benzamide IUPAC Name: 3-butoxy-N-[[4-(3-methylbutoxy)phenyl]carbamothioyl]benzamide Traditional Name: 3-butoxy-N-[(4-isoamoxyphenyl)thiocarbamoyl]benzamide Formula: C23H30N2O3S MolecularWeight: 414.5609

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC(C)C

Isomeric SMILES

CCCCOC1=CC=CC(=C1)C(=O)NC(=S)NC2=CC=C(C=C2)OCCC(C)C

InChI

InChI=1S/C23H30N2O3S/c1-4-5-14-27-21-8-6-7-18(16-21)22(26)25-23(29)24-19-9-11-20(12-10-19)28-15-13-17(2)3/h6-12,16-17H,4-5,13-15H2,1-3H3,(H2,24,25,26,29)