4-heptoxy-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide

Systemtic Name: 4-heptoxy-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide Openeye Name: 4-heptoxy-N-[[2-(2-naphthyloxy)propanoylamino]carbamothioyl]benzamide CAS Name: 4-heptoxy-N-[[[2-(2-naphthalenyloxy)-1-oxopropyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 4-heptoxy-N-[(2-naphthalen-2-yloxypropanoylamino)carbamothioyl]benzamide Traditional Name: 4-heptoxy-N-[[2-(2-naphthoxy)propanoylamino]thiocarbamoyl]benzamide Formula: C28H33N3O4S MolecularWeight: 507.64432

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CCCCCCCOC1=CC=C(C=C1)C(=O)NC(=S)NNC(=O)C(C)OC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C28H33N3O4S/c1-3-4-5-6-9-18-34-24-15-13-22(14-16-24)27(33)29-28(36)31-30-26(32)20(2)35-25-17-12-21-10-7-8-11-23(21)19-25/h7-8,10-17,19-20H,3-6,9,18H2,1-2H3,(H,30,32)(H2,29,31,33,36)