N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-3-phenethyloxy-benzamide

Systemtic Name: N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-3-phenethyloxy-benzamide Openeye Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-3-phenethyloxy-benzamide CAS Name: N-[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-3-phenethyloxybenzamide IUPAC Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-3-phenethyloxybenzamide Traditional Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]thiocarbamoyl]-3-phenethyloxy-benzamide Formula: C33H33N3O3S MolecularWeight: 551.69842

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC(=CC=C2)NC(=S)NC(=O)C3=CC(=CC=C3)OCCC4=CC=CC=C4

InChI

InChI=1S/C33H33N3O3S/c1-33(2,3)26-17-15-24(16-18-26)30(37)34-27-12-8-13-28(22-27)35-32(40)36-31(38)25-11-7-14-29(21-25)39-20-19-23-9-5-4-6-10-23/h4-18,21-22H,19-20H2,1-3H3,(H,34,37)(H2,35,36,38,40)