N-[(4-hexoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide

Systemtic Name: N-[(4-hexoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: N-[(4-hexoxyphenyl)carbamothioyl]-2-isopentyloxy-benzamide CAS Name: N-[(4-hexoxyanilino)-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: N-[(4-hexoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: N-[(4-hexoxyphenyl)thiocarbamoyl]-2-isoamoxy-benzamide Formula: C25H34N2O3S MolecularWeight: 442.61406

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C25H34N2O3S/c1-4-5-6-9-17-29-21-14-12-20(13-15-21)26-25(31)27-24(28)22-10-7-8-11-23(22)30-18-16-19(2)3/h7-8,10-15,19H,4-6,9,16-18H2,1-3H3,(H2,26,27,28,31)