N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-2,4-dimethoxy-benzamide

Systemtic Name: N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-2,4-dimethoxy-benzamide Openeye Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-2,4-dimethoxy-benzamide CAS Name: N-[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-2,4-dimethoxybenzamide IUPAC Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-2,4-dimethoxybenzamide Traditional Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]thiocarbamoyl]-2,4-dimethoxy-benzamide Formula: C27H29N3O4S MolecularWeight: 491.60186

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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=C(C=C(C=C3)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O4S/c1-27(2,3)18-11-9-17(10-12-18)24(31)28-19-7-6-8-20(15-19)29-26(35)30-25(32)22-14-13-21(33-4)16-23(22)34-5/h6-16H,1-5H3,(H,28,31)(H2,29,30,32,35)