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

Systemtic Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-pentoxy-benzamide Openeye Name: N-[(3-isopentyloxyphenyl)carbamothioyl]-4-pentoxy-benzamide CAS Name: N-[[3-(3-methylbutoxy)anilino]-sulfanylidenemethyl]-4-pentoxybenzamide IUPAC Name: N-[[3-(3-methylbutoxy)phenyl]carbamothioyl]-4-pentoxybenzamide Traditional Name: 4-amoxy-N-[(3-isoamoxyphenyl)thiocarbamoyl]benzamide Formula: C24H32N2O3S MolecularWeight: 428.58748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC(C)C

Isomeric SMILES

CCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NC2=CC(=CC=C2)OCCC(C)C

InChI

InChI=1S/C24H32N2O3S/c1-4-5-6-15-28-21-12-10-19(11-13-21)23(27)26-24(30)25-20-8-7-9-22(17-20)29-16-14-18(2)3/h7-13,17-18H,4-6,14-16H2,1-3H3,(H2,25,26,27,30)