2-hexoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide

Systemtic Name: 2-hexoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Openeye Name: 2-hexoxy-N-[(2-isopropylphenyl)carbamothioyl]benzamide CAS Name: 2-hexoxy-N-[(2-propan-2-ylanilino)-sulfanylidenemethyl]benzamide IUPAC Name: 2-hexoxy-N-[(2-propan-2-ylphenyl)carbamothioyl]benzamide Traditional Name: 2-hexoxy-N-(o-cumenylthiocarbamoyl)benzamide Formula: C23H30N2O2S MolecularWeight: 398.5615

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(C)C

Isomeric SMILES

CCCCCCOC1=CC=CC=C1C(=O)NC(=S)NC2=CC=CC=C2C(C)C

InChI

InChI=1S/C23H30N2O2S/c1-4-5-6-11-16-27-21-15-10-8-13-19(21)22(26)25-23(28)24-20-14-9-7-12-18(20)17(2)3/h7-10,12-15,17H,4-6,11,16H2,1-3H3,(H2,24,25,26,28)