N-[3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]phenyl]-2-chloranyl-benzamide

Systemtic Name: N-[3-[(4-tert-butylphenyl)carbonylcarbamothioylamino]phenyl]-2-chloranyl-benzamide Openeye Name: N-[3-[(4-tert-butylbenzoyl)carbamothioylamino]phenyl]-2-chloro-benzamide CAS Name: N-[3-[[[[(4-tert-butylphenyl)-oxomethyl]amino]-sulfanylidenemethyl]amino]phenyl]-2-chlorobenzamide IUPAC Name: N-[3-[(4-tert-butylbenzoyl)carbamothioylamino]phenyl]-2-chlorobenzamide Traditional Name: N-[3-[(4-tert-butylbenzoyl)thiocarbamoylamino]phenyl]-2-chloro-benzamide Formula: C25H24ClN3O2S MolecularWeight: 465.99496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3Cl

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC(=S)NC2=CC=CC(=C2)NC(=O)C3=CC=CC=C3Cl

InChI

InChI=1S/C25H24ClN3O2S/c1-25(2,3)17-13-11-16(12-14-17)22(30)29-24(32)28-19-8-6-7-18(15-19)27-23(31)20-9-4-5-10-21(20)26/h4-15H,1-3H3,(H,27,31)(H2,28,29,30,32)