N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-2-chloranyl-4-methyl-benzamide

Systemtic Name: N-[[3-[(4-tert-butylphenyl)carbonylamino]phenyl]carbamothioyl]-2-chloranyl-4-methyl-benzamide Openeye Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-2-chloro-4-methyl-benzamide CAS Name: N-[[3-[[(4-tert-butylphenyl)-oxomethyl]amino]anilino]-sulfanylidenemethyl]-2-chloro-4-methylbenzamide IUPAC Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]carbamothioyl]-2-chloro-4-methylbenzamide Traditional Name: N-[[3-[(4-tert-butylbenzoyl)amino]phenyl]thiocarbamoyl]-2-chloro-4-methyl-benzamide Formula: C26H26ClN3O2S MolecularWeight: 480.02154

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)Cl

Isomeric SMILES

CC1=CC(=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=C(C=C3)C(C)(C)C)Cl

InChI

InChI=1S/C26H26ClN3O2S/c1-16-8-13-21(22(27)14-16)24(32)30-25(33)29-20-7-5-6-19(15-20)28-23(31)17-9-11-18(12-10-17)26(2,3)4/h5-15H,1-4H3,(H,28,31)(H2,29,30,32,33)