N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-4-heptoxy-benzamide

Systemtic Name: N-[[(4-tert-butylphenyl)carbonylamino]carbamothioyl]-4-heptoxy-benzamide Openeye Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-4-heptoxy-benzamide CAS Name: N-[[[(4-tert-butylphenyl)-oxomethyl]hydrazo]-sulfanylidenemethyl]-4-heptoxybenzamide IUPAC Name: N-[[(4-tert-butylbenzoyl)amino]carbamothioyl]-4-heptoxybenzamide Traditional Name: N-[[(4-tert-butylbenzoyl)amino]thiocarbamoyl]-4-heptoxy-benzamide Formula: C26H35N3O3S MolecularWeight: 469.6394

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H35N3O3S/c1-5-6-7-8-9-18-32-22-16-12-19(13-17-22)23(30)27-25(33)29-28-24(31)20-10-14-21(15-11-20)26(2,3)4/h10-17H,5-9,18H2,1-4H3,(H,28,31)(H2,27,29,30,33)