N-[(3-butan-2-yloxyphenyl)carbamothioyl]-3-butoxy-benzamide

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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