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

Systemtic Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-hexoxy-benzamide Openeye Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-hexoxy-benzamide CAS Name: N-[[3-[(N-ethylanilino)-oxomethyl]anilino]-sulfanylidenemethyl]-2-hexoxybenzamide IUPAC Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]carbamothioyl]-2-hexoxybenzamide Traditional Name: N-[[3-[ethyl(phenyl)carbamoyl]phenyl]thiocarbamoyl]-2-hexoxy-benzamide Formula: C29H33N3O3S MolecularWeight: 503.65562

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)C3=CC=CC=C3

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC(=C2)C(=O)N(CC)C3=CC=CC=C3

InChI

InChI=1S/C29H33N3O3S/c1-3-5-6-12-20-35-26-19-11-10-18-25(26)27(33)31-29(36)30-23-15-13-14-22(21-23)28(34)32(4-2)24-16-8-7-9-17-24/h7-11,13-19,21H,3-6,12,20H2,1-2H3,(H2,30,31,33,36)