3-(3-methylbutoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide

Systemtic Name: 3-(3-methylbutoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide Openeye Name: 3-isopentyloxy-N-[(3-propoxyphenyl)carbamothioyl]benzamide CAS Name: 3-(3-methylbutoxy)-N-[(3-propoxyanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 3-(3-methylbutoxy)-N-[(3-propoxyphenyl)carbamothioyl]benzamide Traditional Name: 3-isoamoxy-N-[(3-propoxyphenyl)thiocarbamoyl]benzamide Formula: C22H28N2O3S MolecularWeight: 400.53432

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H28N2O3S/c1-4-12-26-20-10-6-8-18(15-20)23-22(28)24-21(25)17-7-5-9-19(14-17)27-13-11-16(2)3/h5-10,14-16H,4,11-13H2,1-3H3,(H2,23,24,25,28)