4-butan-2-yloxy-N-[(3-butoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 4-butan-2-yloxy-N-[(3-butoxyphenyl)carbamothioyl]benzamide Openeye Name: N-[(3-butoxyphenyl)carbamothioyl]-4-sec-butoxy-benzamide CAS Name: 4-butan-2-yloxy-N-[(3-butoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 4-butan-2-yloxy-N-[(3-butoxyphenyl)carbamothioyl]benzamide Traditional Name: N-[(3-butoxyphenyl)thiocarbamoyl]-4-sec-butoxy-benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)CC

Isomeric SMILES

CCCCOC1=CC=CC(=C1)NC(=S)NC(=O)C2=CC=C(C=C2)OC(C)CC

InChI

InChI=1S/C22H28N2O3S/c1-4-6-14-26-20-9-7-8-18(15-20)23-22(28)24-21(25)17-10-12-19(13-11-17)27-16(3)5-2/h7-13,15-16H,4-6,14H2,1-3H3,(H2,23,24,25,28)