2-bromanyl-N-[[[4-(cyclohexylcarbonylamino)phenyl]carbonylamino]carbamothioyl]benzamide

Systemtic Name: 2-bromanyl-N-[[[4-(cyclohexylcarbonylamino)phenyl]carbonylamino]carbamothioyl]benzamide Openeye Name: 2-bromo-N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]benzamide CAS Name: 2-bromo-N-[[[[4-[[cyclohexyl(oxo)methyl]amino]phenyl]-oxomethyl]hydrazo]-sulfanylidenemethyl]benzamide IUPAC Name: 2-bromo-N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]carbamothioyl]benzamide Traditional Name: 2-bromo-N-[[[4-(cyclohexanecarbonylamino)benzoyl]amino]thiocarbamoyl]benzamide Formula: C22H23BrN4O3S MolecularWeight: 503.41202

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

Isomeric SMILES

C1CCC(CC1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)C3=CC=CC=C3Br

InChI

InChI=1S/C22H23BrN4O3S/c23-18-9-5-4-8-17(18)21(30)25-22(31)27-26-20(29)15-10-12-16(13-11-15)24-19(28)14-6-2-1-3-7-14/h4-5,8-14H,1-3,6-7H2,(H,24,28)(H,26,29)(H2,25,27,30,31)