4-tert-butyl-N-[4-[(prop-2-enylcarbamothioylamino)carbamoyl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[(prop-2-enylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: N-[4-[(allylcarbamothioylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide CAS Name: 4-tert-butyl-N-[4-[oxo-[[(prop-2-enylamino)-sulfanylidenemethyl]hydrazo]methyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[(prop-2-enylcarbamothioylamino)carbamoyl]phenyl]benzamide Traditional Name: N-[4-[(allylthiocarbamoylamino)carbamoyl]phenyl]-4-tert-butyl-benzamide Formula: C22H26N4O2S MolecularWeight: 410.53244

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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)NCC=C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NCC=C

InChI

InChI=1S/C22H26N4O2S/c1-5-14-23-21(29)26-25-20(28)16-8-12-18(13-9-16)24-19(27)15-6-10-17(11-7-15)22(2,3)4/h5-13H,1,14H2,2-4H3,(H,24,27)(H,25,28)(H2,23,26,29)