N-(heptylcarbamothioyl)-3-(3-methylbutoxy)benzamide

Systemtic Name: N-(heptylcarbamothioyl)-3-(3-methylbutoxy)benzamide Openeye Name: N-(heptylcarbamothioyl)-3-isopentyloxy-benzamide CAS Name: N-[(heptylamino)-sulfanylidenemethyl]-3-(3-methylbutoxy)benzamide IUPAC Name: N-(heptylcarbamothioyl)-3-(3-methylbutoxy)benzamide Traditional Name: N-(heptylthiocarbamoyl)-3-isoamoxy-benzamide Formula: C20H32N2O2S MolecularWeight: 364.54528

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=S)NC(=O)C1=CC(=CC=C1)OCCC(C)C

Isomeric SMILES

CCCCCCCNC(=S)NC(=O)C1=CC(=CC=C1)OCCC(C)C

InChI

InChI=1S/C20H32N2O2S/c1-4-5-6-7-8-13-21-20(25)22-19(23)17-10-9-11-18(15-17)24-14-12-16(2)3/h9-11,15-16H,4-8,12-14H2,1-3H3,(H2,21,22,23,25)