4-tert-butyl-N-[4-[(phenylcarbonylcarbamothioylamino)carbamoyl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[(phenylcarbonylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: N-[4-[(benzoylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide CAS Name: N-[4-[[[benzamido(sulfanylidene)methyl]hydrazo]-oxomethyl]phenyl]-4-tert-butylbenzamide IUPAC Name: N-[4-[(benzoylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butylbenzamide Traditional Name: N-[4-[(benzoylthiocarbamoylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide Formula: C26H26N4O3S MolecularWeight: 474.57464

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H26N4O3S/c1-26(2,3)20-13-9-18(10-14-20)22(31)27-21-15-11-19(12-16-21)24(33)29-30-25(34)28-23(32)17-7-5-4-6-8-17/h4-16H,1-3H3,(H,27,31)(H,29,33)(H2,28,30,32,34)