N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxy-benzamide

Systemtic Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxy-benzamide Openeye Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxy-benzamide CAS Name: N-[[3-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-pentoxybenzamide IUPAC Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-pentoxybenzamide Traditional Name: 2-amoxy-N-[[3-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]benzamide Formula: C28H31N3O3S MolecularWeight: 489.62904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)C3=CC=CC=C3

InChI

InChI=1S/C28H31N3O3S/c1-3-5-11-19-34-25-18-10-9-17-24(25)26(32)30-28(35)29-22-14-12-13-21(20-22)27(33)31(4-2)23-15-7-6-8-16-23/h6-10,12-18,20H,3-5,11,19H2,1-2H3,(H2,29,30,32,35)