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

Systemtic Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Openeye Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-isopentyloxy-benzamide CAS Name: N-[(4-heptoxyanilino)-sulfanylidenemethyl]-2-(3-methylbutoxy)benzamide IUPAC Name: N-[(4-heptoxyphenyl)carbamothioyl]-2-(3-methylbutoxy)benzamide Traditional Name: N-[(4-heptoxyphenyl)thiocarbamoyl]-2-isoamoxy-benzamide Formula: C26H36N2O3S MolecularWeight: 456.64064

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)NC(=S)NC(=O)C2=CC=CC=C2OCCC(C)C

InChI

InChI=1S/C26H36N2O3S/c1-4-5-6-7-10-18-30-22-15-13-21(14-16-22)27-26(32)28-25(29)23-11-8-9-12-24(23)31-19-17-20(2)3/h8-9,11-16,20H,4-7,10,17-19H2,1-3H3,(H2,27,28,29,32)