4-tert-butyl-N-[4-[(2-naphthalen-1-ylethanoylcarbamothioylamino)carbamoyl]phenyl]benzamide

Systemtic Name: 4-tert-butyl-N-[4-[(2-naphthalen-1-ylethanoylcarbamothioylamino)carbamoyl]phenyl]benzamide Openeye Name: 4-tert-butyl-N-[4-[[[2-(1-naphthyl)acetyl]carbamothioylamino]carbamoyl]phenyl]benzamide CAS Name: 4-tert-butyl-N-[4-[[[[[2-(1-naphthalenyl)-1-oxoethyl]amino]-sulfanylidenemethyl]hydrazo]-oxomethyl]phenyl]benzamide IUPAC Name: 4-tert-butyl-N-[4-[[(2-naphthalen-1-ylacetyl)carbamothioylamino]carbamoyl]phenyl]benzamide Traditional Name: 4-tert-butyl-N-[4-[[[2-(1-naphthyl)acetyl]thiocarbamoylamino]carbamoyl]phenyl]benzamide Formula: C31H30N4O3S MolecularWeight: 538.6599

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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)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C(=O)NC2=CC=C(C=C2)C(=O)NNC(=S)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C31H30N4O3S/c1-31(2,3)24-15-11-21(12-16-24)28(37)32-25-17-13-22(14-18-25)29(38)34-35-30(39)33-27(36)19-23-9-6-8-20-7-4-5-10-26(20)23/h4-18H,19H2,1-3H3,(H,32,37)(H,34,38)(H2,33,35,36,39)